Molecule Editor

Molecule ID: FYI-1015562 Edit

Molecule Structure InChIKey: NWZAUGAMTXYDIL-CFTQTYTLSA-N

Molecule Structure SMILES String: CSCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@

Download SDF Download SVG Structure in 2D SDF:

Image not available

FYI-1015562
FYIcenter.com

151151  0  0  1  0  0  0  0  0999 V2000
   63.0467    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   64.2591    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   65.4717    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   65.4717    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   66.6841    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   64.2591    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   65.4717    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   63.0467    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   63.0467    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   64.2591    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   65.4717    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   66.6841    6.3000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   67.8965    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   61.8343    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   60.6219    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   61.8343    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   60.6219    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   59.4094    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   59.4094    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   58.1970    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   60.6219    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   61.8343   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   59.4094   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   59.4094   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   58.1970   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   56.9846   11.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   58.1970   14.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   56.9846   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   24.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   55.7722   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   54.5596   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   53.3472   14.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   52.1348   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   56.9846   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   58.1970   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   55.7722   16.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   55.7722   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   54.5596   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   53.3472   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   54.5596   20.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   53.3472   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   53.3472   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   52.1348   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   52.1348   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   53.3472   25.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   50.9224   25.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   52.1348   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   52.1348   18.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   50.9224   21.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   49.7099   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   49.7099   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.2851   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.2851   14.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.2851   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   47.2851   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   47.2851   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   49.7099   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   48.4975   26.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   46.0727   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0727   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.8601   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.8601   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   42.4353   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.4353   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   41.2229   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   40.0104   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0104   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5856   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3732   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3732   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5856   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606   27.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   37.5856   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   36.3732   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3732   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5856   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   32.7358   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5234   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5234   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   29.0985   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0985   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8861   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6737   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8861   18.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8861   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8861   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6737   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   27.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   27.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866   27.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616   27.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616   23.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616   20.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   22.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   23.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   28.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  3 20  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  4  1  0  0  0  0
  7  2  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
 10  9  1  6  0  0  0
 11 20  2  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 10  1  0  0  0  0
 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  1  0  0  0
 20114  1  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
 23 21  1  0  0  0  0
 24 19  1  0  0  0  0
 25 24  2  0  0  0  0
 26 24  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  2  0  0  0  0
 30 28  1  0  0  0  0
 31 30  1  1  0  0  0
 32 55  1  0  0  0  0
 33 31  1  0  0  0  0
 34 33  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  1  0  0  0  0
 37 31  1  0  0  0  0
 38 37  2  0  0  0  0
 39 37  1  0  0  0  0
 40 39  1  0  0  0  0
 41 40  1  0  0  0  0
 42 41  2  0  0  0  0
 43 41  1  0  0  0  0
 44 43  1  6  0  0  0
 45 55  2  0  0  0  0
 46 44  1  0  0  0  0
 47 46  1  0  0  0  0
 48 47  1  0  0  0  0
 49 48  2  0  0  0  0
 50 48  1  0  0  0  0
 51 44  1  0  0  0  0
 52 51  2  0  0  0  0
 53 51  1  0  0  0  0
 54 53  1  1  0  0  0
 55 65  1  0  0  0  0
 56 54  1  0  0  0  0
 57 56  1  0  0  0  0
 58 57  1  0  0  0  0
 59 58  1  0  0  0  0
 60 59  1  0  0  0  0
 61 54  1  0  0  0  0
 62 61  2  0  0  0  0
 63 61  1  0  0  0  0
 64 63  1  6  0  0  0
 65 74  1  0  0  0  0
 66 64  1  0  0  0  0
 67 66  1  0  0  0  0
 68 67  2  0  0  0  0
 69 67  1  0  0  0  0
 70 64  1  0  0  0  0
 71 70  2  0  0  0  0
 72 70  1  0  0  0  0
 73 72  1  1  0  0  0
 74 93  1  0  0  0  0
 75 73  1  0  0  0  0
 76 75  1  0  0  0  0
 77 73  1  0  0  0  0
 78 77  2  0  0  0  0
 79 77  1  0  0  0  0
 80 79  1  6  0  0  0
 81 80  1  0  0  0  0
 82 81  1  0  0  0  0
 83 82  2  0  0  0  0
 84 83  1  0  0  0  0
 85 84  2  0  0  0  0
 86 85  1  0  0  0  0
 87 86  2  0  0  0  0
 87 82  1  0  0  0  0
 88 85  1  0  0  0  0
 89 80  1  0  0  0  0
 90 89  2  0  0  0  0
 91 89  1  0  0  0  0
 92 91  1  1  0  0  0
 93105  1  0  0  0  0
 94 92  1  0  0  0  0
 95 94  1  0  0  0  0
 96 94  1  0  0  0  0
 97 92  1  0  0  0  0
 98 97  2  0  0  0  0
 99 97  1  0  0  0  0
100 99  1  0  0  0  0
101100  1  0  0  0  0
102101  2  0  0  0  0
103101  1  0  0  0  0
104103  1  1  0  0  0
105114  1  0  0  0  0
106104  1  0  0  0  0
107106  1  0  0  0  0
108107  2  0  0  0  0
109107  1  0  0  0  0
110104  1  0  0  0  0
111110  2  0  0  0  0
112110  1  0  0  0  0
113112  1  6  0  0  0
114124  1  0  0  0  0
115113  1  0  0  0  0
116115  1  0  0  0  0
117116  1  0  0  0  0
118117  2  0  0  0  0
119117  1  0  0  0  0
120113  1  0  0  0  0
121120  2  0  0  0  0
122120  1  0  0  0  0
123122  1  1  0  0  0
124140  1  0  0  0  0
125123  1  0  0  0  0
126123  1  0  0  0  0
127126  2  0  0  0  0
128126  1  0  0  0  0
129128  1  6  0  0  0
130140  2  0  0  0  0
131129  1  0  0  0  0
132131  1  0  0  0  0
133132  1  0  0  0  0
134133  2  0  0  0  0
135133  1  0  0  0  0
136129  1  0  0  0  0
137136  2  0  0  0  0
138136  1  0  0  0  0
139138  1  1  0  0  0
140146  1  0  0  0  0
141139  1  0  0  0  0
142141  1  0  0  0  0
143139  1  0  0  0  0
144143  2  0  0  0  0
145143  1  0  0  0  0
146145  1  6  0  0  0
147151  1  0  0  0  0
148146  1  0  0  0  0
149148  1  0  0  0  0
150149  1  0  0  0  0
151150  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015562-3D
FYIcenter.com

300300  0  0  1  0  0  0  0  0999 V2000
  -22.8013   -0.7133   13.0745 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.0068   -1.7191   14.3420 S   0  0  0  0  0  0  0  0  0  0  0  0
  -20.3239   -1.0271   14.2584 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.3924   -1.7201   15.2569 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.2529   -3.2450   15.0760 C   0  0  2  0  0  0  0  0  0  0  0  0
  -18.3341   -3.7818   16.0616 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5270   -5.0023   16.7012 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.4934   -5.7410   16.5258 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4579   -5.3463   17.7257 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.8548   -4.8630   19.0370 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5442   -5.6059   19.9837 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8654   -6.7788   19.8011 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8046   -4.8802   21.3539 C   0  0  1  0  0  0  0  0  0  0  0  0
  -17.6901   -5.1283   22.2765 N   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6266   -6.2118   23.1286 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4793   -7.0979   23.1421 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4043   -6.2769   24.1068 C   0  0  2  0  0  0  0  0  0  0  0  0
  -16.9425   -6.4148   25.5390 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8219   -6.5616   26.5633 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5252   -6.7787   28.2264 S   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9761   -6.8869   29.1512 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4715   -5.1449   23.9907 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4909   -5.1157   22.9852 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2846   -6.0995   22.2631 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.7807   -3.7350   22.7533 C   0  0  1  0  0  0  0  0  0  0  0  0
  -12.6094   -3.5570   23.6643 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2883   -3.6252   21.2745 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4337   -3.7016   20.2495 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5113   -2.3273   21.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.0210   -3.3460   21.1933 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.1801   -3.0332   20.2410 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.2746   -2.6211   22.5195 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.6331   -3.6224   13.7268 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7792   -2.9275   13.1775 O   0  0  0  0  0  0  0  0  0  0  0  0
  -19.0795   -4.8332   13.2179 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5484   -5.4389   11.9948 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.3632   -5.1153   10.7076 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.3934   -5.7241   10.4132 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.9179   -4.0370    9.9369 N   0  0  0  0  0  0  0  0  0  0  0  0
  -19.5810   -3.5856    8.7199 C   0  0  1  0  0  0  0  0  0  0  0  0
  -20.1381   -2.1658    8.9380 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.8280   -1.6092    7.7145 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.2851   -0.1821    7.8520 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.4676   -0.0276    8.5207 N   0  0  0  0  0  0  0  0  0  0  0  0
  -20.7315    0.7523    7.2696 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5467   -3.5878    7.5446 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3471   -3.3738    7.7144 O   0  0  0  0  0  0  0  0  0  0  0  0
  -19.1348   -3.7000    6.2667 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3846   -3.6130    4.9743 C   0  0  1  0  0  0  0  0  0  0  0  0
  -18.4549   -4.9934    4.2610 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6668   -5.0940    2.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1495   -4.8639    3.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4980   -5.9537    3.9359 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0322   -5.8631    4.0334 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8209   -2.4630    3.9543 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.2042   -2.2550    2.8991 O   0  0  0  0  0  0  0  0  0  0  0  0
  -19.9759   -1.7549    4.2626 N   0  0  0  0  0  0  0  0  0  0  0  0
  -20.5628   -0.6551    3.4177 C   0  0  1  0  0  0  0  0  0  0  0  0
  -21.0703   -1.3084    2.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.6461   -0.3908    1.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.5728    0.8320    1.1204 O   0  0  0  0  0  0  0  0  0  0  0  0
  -22.3823   -1.0252    0.1396 O   0  0  0  0  0  0  0  0  0  0  0  0
  -21.7520    0.0299    4.1984 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.1513   -0.5014    5.2417 O   0  0  0  0  0  0  0  0  0  0  0  0
  -22.3098    1.2060    3.7122 N   0  0  0  0  0  0  0  0  0  0  0  0
  -23.4292    1.9817    4.3415 C   0  0  1  0  0  0  0  0  0  0  0  0
  -22.9735    2.5823    5.6542 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.8958    3.4261    5.3370 O   0  0  0  0  0  0  0  0  0  0  0  0
  -23.7994    3.1945    3.4359 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.2047    3.3983    2.3783 O   0  0  0  0  0  0  0  0  0  0  0  0
  -24.7769    4.0622    3.9369 N   0  0  0  0  0  0  0  0  0  0  0  0
  -25.3298    5.2207    3.1724 C   0  0  1  0  0  0  0  0  0  0  0  0
  -25.8548    4.7961    1.7928 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.0114    3.8324    1.8302 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.5671    3.3383    3.0048 C   0  0  0  0  0  0  0  0  0  0  0  0
  -28.5537    2.3954    2.9730 C   0  0  0  0  0  0  0  0  0  0  0  0
  -29.0126    1.9049    1.7394 C   0  0  0  0  0  0  0  0  0  0  0  0
  -29.9521    0.9091    1.6693 O   0  0  0  0  0  0  0  0  0  0  0  0
  -28.5976    2.4966    0.5505 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.5515    3.4501    0.6014 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.4604    5.9589    3.9843 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.8599    5.5511    5.0787 O   0  0  0  0  0  0  0  0  0  0  0  0
  -26.9712    7.1132    3.3981 N   0  0  0  0  0  0  0  0  0  0  0  0
  -27.9308    8.0118    4.0543 C   0  0  2  0  0  0  0  0  0  0  0  0
  -29.3253    7.9958    3.3829 C   0  0  0  0  0  0  0  0  0  0  0  0
  -29.9942    9.0065    3.1864 O   0  0  0  0  0  0  0  0  0  0  0  0
  -29.8568    6.7444    3.1744 N   0  0  0  0  0  0  0  0  0  0  0  0
  -31.1649    6.6036    2.5551 C   0  0  0  0  0  0  0  0  0  0  0  0
  -31.1781    5.3320    1.7695 C   0  0  0  0  0  0  0  0  0  0  0  0
  -30.2370    4.5576    1.8838 O   0  0  0  0  0  0  0  0  0  0  0  0
  -32.3386    5.0992    1.0504 N   0  0  0  0  0  0  0  0  0  0  0  0
  -32.6723    3.8043    0.3875 C   0  0  1  0  0  0  0  0  0  0  0  0
  -31.9987    2.6201    1.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
  -32.3900    2.3257    2.4781 C   0  0  0  0  0  0  0  0  0  0  0  0
  -33.5658    2.2801    2.9269 O   0  0  0  0  0  0  0  0  0  0  0  0
  -31.4646    1.8708    3.3152 O   0  0  0  0  0  0  0  0  0  0  0  0
  -34.1520    3.4645    0.3922 C   0  0  0  0  0  0  0  0  0  0  0  0
  -34.9286    4.1339    1.0667 O   0  0  0  0  0  0  0  0  0  0  0  0
  -34.4266    2.2674   -0.2787 N   0  0  0  0  0  0  0  0  0  0  0  0
  -35.7578    1.6357   -0.3083 C   0  0  1  0  0  0  0  0  0  0  0  0
  -36.7890    2.5707   -0.9490 C   0  0  0  0  0  0  0  0  0  0  0  0
  -36.4001    2.9500   -2.3888 C   0  0  0  0  0  0  0  0  0  0  0  0
  -37.2835    3.9992   -3.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
  -37.8808    3.8621   -4.0843 O   0  0  0  0  0  0  0  0  0  0  0  0
  -37.2232    5.1413   -2.3053 O   0  0  0  0  0  0  0  0  0  0  0  0
  -35.6293    0.2754   -1.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
  -34.5099   -0.0546   -1.4452 O   0  0  0  0  0  0  0  0  0  0  0  0
  -36.8045   -0.4803   -1.1025 N   0  0  0  0  0  0  0  0  0  0  0  0
  -37.0680   -1.8167   -1.7795 C   0  0  1  0  0  0  0  0  0  0  0  0
  -36.1679   -2.8744   -1.1527 C   0  0  0  0  0  0  0  0  0  0  0  0
  -38.5722   -2.3384   -1.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
  -39.4443   -1.6344   -1.1702 O   0  0  0  0  0  0  0  0  0  0  0  0
  -38.8075   -3.6164   -2.1789 N   0  0  0  0  0  0  0  0  0  0  0  0
  -40.1257   -4.3637   -2.1334 C   0  0  1  0  0  0  0  0  0  0  0  0
  -41.0064   -3.9982   -3.3619 C   0  0  0  0  0  0  0  0  0  0  0  0
  -42.3926   -4.6698   -3.3665 C   0  0  0  0  0  0  0  0  0  0  0  0
  -43.2478   -4.3378   -4.5776 C   0  0  0  0  0  0  0  0  0  0  0  0
  -44.4986   -4.8663   -4.5794 N   0  0  0  0  0  0  0  0  0  0  0  0
  -42.8222   -3.6757   -5.4931 O   0  0  0  0  0  0  0  0  0  0  0  0
  -39.8985   -5.9216   -2.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
  -38.9390   -6.4107   -2.7021 O   0  0  0  0  0  0  0  0  0  0  0  0
  -40.8509   -6.6956   -1.4867 N   0  0  0  0  0  0  0  0  0  0  0  0
  -40.8490   -8.1848   -1.4074 C   0  0  1  0  0  0  0  0  0  0  0  0
  -39.5822   -8.7226   -0.7241 C   0  0  0  0  0  0  0  0  0  0  0  0
  -39.3838   -8.1577    0.5736 O   0  0  0  0  0  0  0  0  0  0  0  0
  -42.1059   -8.6394   -0.5887 C   0  0  0  0  0  0  0  0  0  0  0  0
  -42.6219   -7.8575    0.2117 O   0  0  0  0  0  0  0  0  0  0  0  0
  -42.4900   -9.9654   -0.7806 N   0  0  0  0  0  0  0  0  0  0  0  0
  -43.5350  -10.7038   -0.0112 C   0  0  1  0  0  0  0  0  0  0  0  0
  -44.8628   -9.9631    0.0388 C   0  0  0  0  0  0  0  0  0  0  0  0
  -45.4636   -9.8066   -1.3623 C   0  0  0  0  0  0  0  0  0  0  0  0
  -46.7705   -9.0178   -1.3293 C   0  0  0  0  0  0  0  0  0  0  0  0
  -46.6193   -7.6471   -0.6722 C   0  0  0  0  0  0  0  0  0  0  0  0
  -45.5601   -6.9155   -1.3330 N   0  0  0  0  0  0  0  0  0  0  0  0
  -43.7680  -12.1187   -0.6155 C   0  0  0  0  0  0  0  0  0  0  0  0
  -43.1383  -12.4842   -1.6059 O   0  0  0  0  0  0  0  0  0  0  0  0
  -44.7574  -12.8746    0.0135 N   0  0  0  0  0  0  0  0  0  0  0  0
  -45.2644  -14.1565   -0.4615 C   0  0  3  0  0  0  0  0  0  0  0  0
  -44.4339  -15.2873    0.1384 C   0  0  0  0  0  0  0  0  0  0  0  0
  -44.8588  -16.6456   -0.4016 C   0  0  0  0  0  0  0  0  0  0  0  0
  -44.0477  -17.7763    0.1617 C   0  0  0  0  0  0  0  0  0  0  0  0
  -44.5778  -19.0278   -0.3590 N   0  0  0  0  0  0  0  0  0  0  0  0
  -44.0837  -20.2440   -0.0267 C   0  0  0  0  0  0  0  0  0  0  0  0
  -43.1360  -20.4591    0.8281 N   0  0  0  0  0  0  0  0  0  0  0  0
  -44.7523  -21.1746   -0.7418 N   0  0  0  0  0  0  0  0  0  0  0  0
  -46.6956  -14.1528    0.0428 C   0  0  0  0  0  0  0  0  0  0  0  0
  -47.1761  -13.2648    0.7403 O   0  0  0  0  0  0  0  0  0  0  0  0
  -47.4349  -15.1934   -0.3566 O   0  0  0  0  0  0  0  0  0  0  0  0
  -27.3744    9.4673    4.2171 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.0269    9.4587    4.9489 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.2071   10.2530    2.9083 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.8637   -0.9725   13.0527 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.3667   -0.9114   12.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.7142    0.3471   13.3246 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.3823    0.0401   14.5039 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.9392   -1.1116   13.2368 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.7574   -1.5193   16.2735 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4087   -1.2314   15.2010 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2196   -3.7402   15.1818 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.5110   -3.2264   16.2688 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5031   -4.8838   17.4608 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3295   -6.4323   17.7530 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7779   -3.8668   19.1743 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.7117   -5.3300   21.7773 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0219   -4.3812   22.3735 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8422   -7.1818   23.8437 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.5631   -5.5415   25.7798 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6008   -7.2930   25.5887 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1912   -5.6678   26.5753 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1979   -7.4289   26.3245 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1987   -6.9981   30.2155 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3814   -5.9800   29.0135 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4006   -7.7568   28.8239 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5662   -4.3649   24.6360 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5035   -2.9330   22.9511 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9587   -4.3294   23.5228 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9024   -3.5910   24.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6107   -4.4651   21.0683 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1399   -2.8742   20.3743 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9928   -4.6385   20.3166 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0336   -3.6466   19.2292 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1475   -1.4496   21.1695 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1442   -2.3001   19.9815 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6370   -2.2382   21.6648 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.1036   -2.8951   20.7929 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.1261   -3.4080   20.6436 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.0426   -3.4738   19.2502 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2717   -1.9518   20.0964 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.1883   -2.9787   23.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.3857   -1.5452   22.3370 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4397   -2.7392   23.2171 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6801   -5.4180   13.7998 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5829   -6.5275   12.1374 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.5003   -5.1608   11.8516 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0555   -3.5670   10.1907 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.3892   -4.2808    8.4663 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.3103   -1.4876    9.1830 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.8285   -2.1478    9.7863 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.6566   -2.2443    7.3732 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.0772   -1.5705    6.9376 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.8352   -0.7582    9.1324 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.8292    0.9042    8.7183 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.1264   -3.9177    6.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3391   -3.4093    5.2364 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.5052   -5.2371    4.0539 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.1133   -5.7882    4.9397 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0777   -4.3944    2.2040 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.8443   -6.0778    2.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.9511   -3.8672    3.4852 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7121   -4.8716    2.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7542   -6.9289    3.5088 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.9236   -5.9181    4.9448 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5964   -5.9233    3.1210 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6906   -6.6260    4.6152 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2114   -1.7768    5.2451 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.7605    0.0768    3.2611 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.8521   -2.0201    2.4088 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2607   -1.8613    1.6381 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.4585   -2.0010    0.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.1092    1.5273    2.7762 H   0  0  0  0  0  0  0  0  0  0  0  0
  -24.2829    1.3032    4.4691 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.6718    1.8438    6.3878 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.7587    3.1884    6.1161 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.0527    2.9463    5.2793 H   0  0  0  0  0  0  0  0  0  0  0  0
  -25.2413    3.9732    4.8419 H   0  0  0  0  0  0  0  0  0  0  0  0
  -24.4859    5.9071    3.0553 H   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0652    4.3146    1.2076 H   0  0  0  0  0  0  0  0  0  0  0  0
  -26.1631    5.6849    1.2312 H   0  0  0  0  0  0  0  0  0  0  0  0
  -27.3397    3.6997    3.9986 H   0  0  0  0  0  0  0  0  0  0  0  0
  -29.0406    2.1955    3.9236 H   0  0  0  0  0  0  0  0  0  0  0  0
  -30.8233    1.0415    2.0955 H   0  0  0  0  0  0  0  0  0  0  0  0
  -29.1219    2.3254   -0.3777 H   0  0  0  0  0  0  0  0  0  0  0  0
  -27.2191    3.8852   -0.3207 H   0  0  0  0  0  0  0  0  0  0  0  0
  -26.5511    7.4694    2.5513 H   0  0  0  0  0  0  0  0  0  0  0  0
  -28.1048    7.6392    5.0733 H   0  0  0  0  0  0  0  0  0  0  0  0
  -29.2053    5.9546    3.1510 H   0  0  0  0  0  0  0  0  0  0  0  0
  -31.3571    7.4457    1.8859 H   0  0  0  0  0  0  0  0  0  0  0  0
  -31.9132    6.5730    3.3523 H   0  0  0  0  0  0  0  0  0  0  0  0
  -33.1520    5.6259    1.3050 H   0  0  0  0  0  0  0  0  0  0  0  0
  -32.3359    3.9289   -0.6491 H   0  0  0  0  0  0  0  0  0  0  0  0
  -30.9615    2.8528    0.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
  -32.1175    1.6880    0.4652 H   0  0  0  0  0  0  0  0  0  0  0  0
  -30.5135    1.8418    3.1922 H   0  0  0  0  0  0  0  0  0  0  0  0
  -33.6470    1.7033   -0.6392 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.0155    1.4106    0.7333 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.8828    3.4650   -0.3211 H   0  0  0  0  0  0  0  0  0  0  0  0
  -37.7801    2.1085   -0.9385 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.4003    2.0576   -3.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
  -35.3848    3.3659   -2.4164 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.6097    5.1286   -1.5287 H   0  0  0  0  0  0  0  0  0  0  0  0
  -37.6007   -0.0207   -0.6834 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.8296   -1.6807   -2.8423 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.4780   -3.0535   -0.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
  -35.1202   -2.5701   -1.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
  -36.2272   -3.8283   -1.6850 H   0  0  0  0  0  0  0  0  0  0  0  0
  -38.0253   -4.1485   -2.5563 H   0  0  0  0  0  0  0  0  0  0  0  0
  -40.6298   -4.0640   -1.2115 H   0  0  0  0  0  0  0  0  0  0  0  0
  -40.4746   -4.2637   -4.2873 H   0  0  0  0  0  0  0  0  0  0  0  0
  -41.1409   -2.9117   -3.3986 H   0  0  0  0  0  0  0  0  0  0  0  0
  -42.9471   -4.3820   -2.4640 H   0  0  0  0  0  0  0  0  0  0  0  0
  -42.2965   -5.7480   -3.3783 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.8217   -5.4379   -3.8090 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.1147   -4.7278   -5.3624 H   0  0  0  0  0  0  0  0  0  0  0  0
  -41.5084   -6.3130   -0.8189 H   0  0  0  0  0  0  0  0  0  0  0  0
  -40.9392   -8.5692   -2.4281 H   0  0  0  0  0  0  0  0  0  0  0  0
  -38.6932   -8.4497   -1.3001 H   0  0  0  0  0  0  0  0  0  0  0  0
  -39.5987   -9.8132   -0.6444 H   0  0  0  0  0  0  0  0  0  0  0  0
  -40.2309   -7.7795    0.8792 H   0  0  0  0  0  0  0  0  0  0  0  0
  -42.0217  -10.5516   -1.4743 H   0  0  0  0  0  0  0  0  0  0  0  0
  -43.1373  -10.8370    1.0018 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.6975   -9.0028    0.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.5874  -10.4837    0.6749 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.6614  -10.7840   -1.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.7408   -9.3239   -2.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
  -47.5248   -9.5973   -0.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
  -47.1327   -8.9085   -2.3593 H   0  0  0  0  0  0  0  0  0  0  0  0
  -46.3454   -7.7447    0.3808 H   0  0  0  0  0  0  0  0  0  0  0  0
  -47.5610   -7.0956   -0.7108 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.6860   -7.4531   -1.3107 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.3442   -6.0532   -0.8436 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.2568  -12.4543    0.7899 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.2508  -14.1576   -1.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.5247  -15.2832    1.2327 H   0  0  0  0  0  0  0  0  0  0  0  0
  -43.3729  -15.1197   -0.0874 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.8165  -16.6464   -1.4975 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.8832  -16.8727   -0.1019 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.1459  -17.7783    1.2558 H   0  0  0  0  0  0  0  0  0  0  0  0
  -42.9927  -17.6658   -0.1015 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.0354  -19.0225   -1.2701 H   0  0  0  0  0  0  0  0  0  0  0  0
  -42.8557  -19.5275    1.1491 H   0  0  0  0  0  0  0  0  0  0  0  0
  -45.6907  -20.9200   -1.0234 H   0  0  0  0  0  0  0  0  0  0  0  0
  -44.6665  -22.1461   -0.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
  -47.0329  -15.7529   -1.0408 H   0  0  0  0  0  0  0  0  0  0  0  0
  -28.0857   10.0330    4.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
  -25.2582    8.9704    4.3408 H   0  0  0  0  0  0  0  0  0  0  0  0
  -26.1001    8.9291    5.9030 H   0  0  0  0  0  0  0  0  0  0  0  0
  -25.6808   10.4783    5.1545 H   0  0  0  0  0  0  0  0  0  0  0  0
  -26.4929    9.7669    2.2389 H   0  0  0  0  0  0  0  0  0  0  0  0
  -26.8325   11.2643    3.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
  -28.1505   10.3783    2.3708 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1152  1  0  0  0  0
  1153  1  0  0  0  0
  1154  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3155  1  0  0  0  0
  3156  1  0  0  0  0
  4157  1  0  0  0  0
  4158  1  0  0  0  0
  5 33  1  0  0  0  0
  5  6  1  0  0  0  0
  5  4  1  0  0  0  0
  5159  1  1  0  0  0
  6  7  1  0  0  0  0
  6160  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9161  1  0  0  0  0
  9162  1  0  0  0  0
 10 11  1  0  0  0  0
 10163  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 30  1  0  0  0  0
 13164  1  1  0  0  0
 14 15  1  0  0  0  0
 14165  1  0  0  0  0
 15 16  2  0  0  0  0
 17 22  1  0  0  0  0
 17 18  1  0  0  0  0
 17 15  1  0  0  0  0
 17166  1  6  0  0  0
 18 19  1  0  0  0  0
 18167  1  0  0  0  0
 18168  1  0  0  0  0
 19 20  1  0  0  0  0
 19169  1  0  0  0  0
 19170  1  0  0  0  0
 20 21  1  0  0  0  0
 21171  1  0  0  0  0
 21172  1  0  0  0  0
 21173  1  0  0  0  0
 22 23  1  0  0  0  0
 22174  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25175  1  1  0  0  0
 26176  1  0  0  0  0
 26177  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27178  1  0  0  0  0
 28179  1  0  0  0  0
 28180  1  0  0  0  0
 28181  1  0  0  0  0
 29182  1  0  0  0  0
 29183  1  0  0  0  0
 29184  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30185  1  0  0  0  0
 31186  1  0  0  0  0
 31187  1  0  0  0  0
 31188  1  0  0  0  0
 32189  1  0  0  0  0
 32190  1  0  0  0  0
 32191  1  0  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35192  1  0  0  0  0
 36 37  1  0  0  0  0
 36193  1  0  0  0  0
 36194  1  0  0  0  0
 37 38  2  0  0  0  0
 37 39  1  0  0  0  0
 39 40  1  0  0  0  0
 39195  1  0  0  0  0
 40 41  1  0  0  0  0
 40 46  1  0  0  0  0
 40196  1  6  0  0  0
 41 42  1  0  0  0  0
 41197  1  0  0  0  0
 41198  1  0  0  0  0
 42 43  1  0  0  0  0
 42199  1  0  0  0  0
 42200  1  0  0  0  0
 43 44  1  0  0  0  0
 43 45  2  0  0  0  0
 44201  1  0  0  0  0
 44202  1  0  0  0  0
 46 47  2  0  0  0  0
 46 48  1  0  0  0  0
 48 49  1  0  0  0  0
 48203  1  0  0  0  0
 49 50  1  0  0  0  0
 49 55  1  0  0  0  0
 49204  1  1  0  0  0
 50 51  1  0  0  0  0
 50205  1  0  0  0  0
 50206  1  0  0  0  0
 51 52  1  0  0  0  0
 51207  1  0  0  0  0
 51208  1  0  0  0  0
 52 53  1  0  0  0  0
 52209  1  0  0  0  0
 52210  1  0  0  0  0
 53 54  1  0  0  0  0
 53211  1  0  0  0  0
 53212  1  0  0  0  0
 54213  1  0  0  0  0
 54214  1  0  0  0  0
 55 56  2  0  0  0  0
 55 57  1  0  0  0  0
 57 58  1  0  0  0  0
 57215  1  0  0  0  0
 58 59  1  0  0  0  0
 58 63  1  0  0  0  0
 58216  1  6  0  0  0
 59 60  1  0  0  0  0
 59217  1  0  0  0  0
 59218  1  0  0  0  0
 60 61  2  0  0  0  0
 60 62  1  0  0  0  0
 62219  1  0  0  0  0
 63 64  2  0  0  0  0
 63 65  1  0  0  0  0
 65 66  1  0  0  0  0
 65220  1  0  0  0  0
 66 67  1  0  0  0  0
 66 69  1  0  0  0  0
 66221  1  1  0  0  0
 67 68  1  0  0  0  0
 67222  1  0  0  0  0
 67223  1  0  0  0  0
 68224  1  0  0  0  0
 69 70  2  0  0  0  0
 69 71  1  0  0  0  0
 71 72  1  0  0  0  0
 71225  1  0  0  0  0
 72 73  1  0  0  0  0
 72 81  1  0  0  0  0
 72226  1  6  0  0  0
 73 74  1  0  0  0  0
 73227  1  0  0  0  0
 73228  1  0  0  0  0
 74 75  1  0  0  0  0
 74 80  2  0  0  0  0
 75 76  2  0  0  0  0
 75229  1  0  0  0  0
 76 77  1  0  0  0  0
 76230  1  0  0  0  0
 77 78  1  0  0  0  0
 77 79  2  0  0  0  0
 78231  1  0  0  0  0
 79 80  1  0  0  0  0
 79232  1  0  0  0  0
 80233  1  0  0  0  0
 81 82  2  0  0  0  0
 81 83  1  0  0  0  0
 83234  1  0  0  0  0
 84149  1  0  0  0  0
 84 85  1  0  0  0  0
 84 83  1  0  0  0  0
 84235  1  1  0  0  0
 85 86  2  0  0  0  0
 85 87  1  0  0  0  0
 87 88  1  0  0  0  0
 87236  1  0  0  0  0
 88 89  1  0  0  0  0
 88237  1  0  0  0  0
 88238  1  0  0  0  0
 89 90  2  0  0  0  0
 89 91  1  0  0  0  0
 91 92  1  0  0  0  0
 91239  1  0  0  0  0
 92 93  1  0  0  0  0
 92 97  1  0  0  0  0
 92240  1  6  0  0  0
 93 94  1  0  0  0  0
 93241  1  0  0  0  0
 93242  1  0  0  0  0
 94 95  2  0  0  0  0
 94 96  1  0  0  0  0
 96243  1  0  0  0  0
 97 98  2  0  0  0  0
 97 99  1  0  0  0  0
 99100  1  0  0  0  0
 99244  1  0  0  0  0
100101  1  0  0  0  0
100106  1  0  0  0  0
100245  1  1  0  0  0
101102  1  0  0  0  0
101246  1  0  0  0  0
101247  1  0  0  0  0
102103  1  0  0  0  0
102248  1  0  0  0  0
102249  1  0  0  0  0
103104  2  0  0  0  0
103105  1  0  0  0  0
105250  1  0  0  0  0
106107  2  0  0  0  0
106108  1  0  0  0  0
108109  1  0  0  0  0
108251  1  0  0  0  0
109110  1  0  0  0  0
109111  1  0  0  0  0
109252  1  6  0  0  0
110253  1  0  0  0  0
110254  1  0  0  0  0
110255  1  0  0  0  0
111112  2  0  0  0  0
111113  1  0  0  0  0
113114  1  0  0  0  0
113256  1  0  0  0  0
114115  1  0  0  0  0
114120  1  0  0  0  0
114257  1  1  0  0  0
115116  1  0  0  0  0
115258  1  0  0  0  0
115259  1  0  0  0  0
116117  1  0  0  0  0
116260  1  0  0  0  0
116261  1  0  0  0  0
117118  1  0  0  0  0
117119  2  0  0  0  0
118262  1  0  0  0  0
118263  1  0  0  0  0
120121  2  0  0  0  0
120122  1  0  0  0  0
122123  1  0  0  0  0
122264  1  0  0  0  0
123124  1  0  0  0  0
123126  1  0  0  0  0
123265  1  6  0  0  0
124125  1  0  0  0  0
124266  1  0  0  0  0
124267  1  0  0  0  0
125268  1  0  0  0  0
126127  2  0  0  0  0
126128  1  0  0  0  0
128129  1  0  0  0  0
128269  1  0  0  0  0
129130  1  0  0  0  0
129135  1  0  0  0  0
129270  1  1  0  0  0
130131  1  0  0  0  0
130271  1  0  0  0  0
130272  1  0  0  0  0
131132  1  0  0  0  0
131273  1  0  0  0  0
131274  1  0  0  0  0
132133  1  0  0  0  0
132275  1  0  0  0  0
132276  1  0  0  0  0
133134  1  0  0  0  0
133277  1  0  0  0  0
133278  1  0  0  0  0
134279  1  0  0  0  0
134280  1  0  0  0  0
135136  2  0  0  0  0
135137  1  0  0  0  0
137138  1  0  0  0  0
137281  1  0  0  0  0
138139  1  0  0  0  0
138146  1  0  0  0  0
138282  1  0  0  0  0
139140  1  0  0  0  0
139283  1  0  0  0  0
139284  1  0  0  0  0
140141  1  0  0  0  0
140285  1  0  0  0  0
140286  1  0  0  0  0
141142  1  0  0  0  0
141287  1  0  0  0  0
141288  1  0  0  0  0
142143  1  0  0  0  0
142289  1  0  0  0  0
143144  2  0  0  0  0
143145  1  0  0  0  0
144290  1  0  0  0  0
145291  1  0  0  0  0
145292  1  0  0  0  0
146147  2  0  0  0  0
146148  1  0  0  0  0
148293  1  0  0  0  0
149150  1  0  0  0  0
149151  1  0  0  0  0
149294  1  0  0  0  0
150295  1  0  0  0  0
150296  1  0  0  0  0
150297  1  0  0  0  0
151298  1  0  0  0  0
151299  1  0  0  0  0
151300  1  0  0  0  0
M  END
$$$$