Molecule FYI-1014181

A

Molecule Summary:

ID: FYI-1014181
Names:
InChIKey: YQZQJMGNIMWVDC-UHFFFAOYSA-O
SMILES: CCC(C)C(NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)[O+](c7ccc6CC(NC(=O)CNC(=O)CCCCCNC(=S)Nc1ccc2c(c1)C(=O)OC25c3ccc(O)cc3Oc4cc(O)ccc45)C(=O)Nc6c7)P(=O)(O)O)C(=O)O

Received at FYIcenter.com on: 2025-03-07

Molecule ID: FYI-1014181 Edit

Molecule Structure InChIKey: YQZQJMGNIMWVDC-UHFFFAOYSA-O

Molecule Structure SMILES String: CCC(C)C(NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)[O+](c7ccc6CC(NC(=O)CNC(=O)CCCCCNC(=S)Nc1ccc2c(c1)C(=O)OC25c3ccc(O)cc3Oc4cc(O)ccc45)C(=O)Nc6c7)P(=O)(O)O)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014181
FYIcenter.com

 83 89  0  0  0  0  0  0  0  0999 V2000
   38.3561   14.4954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.3561   13.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.1426   12.3934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.9290   13.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.1426   10.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.9290   10.2915    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   35.9290    8.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.1426    8.1897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7155    8.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.5020    8.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.2884    8.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.0749    8.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.0749   10.2915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.8614    8.1897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7155    6.7884    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   33.5020    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.2884    6.7884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.5020    4.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7155    3.9858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.9290    4.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.1426    3.9858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.1426    2.5845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.3561    4.6865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.2884    3.9858    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
   31.0749    4.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.0749    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.8614    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6478    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.4343    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.2208    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0073    6.7884    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.7938    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7938    4.6865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5801    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3666    6.0877    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.1531    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1531    8.1897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9396    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7261    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5125    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2990    6.7884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0855    6.0877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3894    7.7617    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.2208    4.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0073    3.9858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.4343    3.9858    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   28.6478    4.6865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.8614    3.9858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.2884    2.5845    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   30.8872    2.5845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.2884    1.1833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.6897    2.5845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.3561   10.2915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.3561    8.8902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   39.5696   10.9922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4559    6.7003    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2423    5.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2423    4.5984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0468    3.9343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8153    4.5984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8153    5.9997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0288    6.7003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4826    6.4327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0496    7.7653    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6589    5.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4826    4.1654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1120    3.8741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1743    4.9154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8037    4.6240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3707    3.2914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3083    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6789    2.5414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6165    1.5001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9872    1.7913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9249    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2955    1.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2331    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7285    2.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7549    3.3425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4202    3.1241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6683    6.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9604    3.7981    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  7  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 12  1  0  0  0  0
 15  9  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  1  0  0  0  0
 24 18  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
 28 27  2  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  2  0  0  0  0
 34 32  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
 38 36  1  0  0  0  0
 39 38  1  0  0  0  0
 40 39  1  0  0  0  0
 41 40  1  0  0  0  0
 42 41  1  0  0  0  0
 43 42  1  0  0  0  0
 44 30  1  0  0  0  0
 45 44  2  0  0  0  0
 46 44  1  0  0  0  0
 47 46  1  0  0  0  0
 47 28  1  0  0  0  0
 48 47  2  0  0  0  0
 48 25  1  0  0  0  0
 49 24  1  0  0  0  0
 50 49  2  0  0  0  0
 51 49  1  0  0  0  0
 52 49  1  0  0  0  0
 53  5  1  0  0  0  0
 54 53  2  0  0  0  0
 55 53  1  0  0  0  0
 57 56  1  0  0  0  0
 58 57  2  0  0  0  0
 59 58  1  0  0  0  0
 60 59  2  0  0  0  0
 61 60  1  0  0  0  0
 62 61  2  0  0  0  0
 62 57  1  0  0  0  0
 63 61  1  0  0  0  0
 64 63  2  0  0  0  0
 65 63  1  0  0  0  0
 66 65  1  0  0  0  0
 66 60  1  0  0  0  0
 67 66  1  0  0  0  0
 68 67  2  0  0  0  0
 69 68  1  0  0  0  0
 70 69  2  0  0  0  0
 71 70  1  0  0  0  0
 72 70  1  0  0  0  0
 73 72  2  0  0  0  0
 73 67  1  0  0  0  0
 74 73  1  0  0  0  0
 75 74  1  0  0  0  0
 76 75  2  0  0  0  0
 77 76  1  0  0  0  0
 78 77  1  0  0  0  0
 79 77  2  0  0  0  0
 80 79  1  0  0  0  0
 81 80  2  0  0  0  0
 81 75  1  0  0  0  0
 81 66  1  0  0  0  0
 56 82  1  0  0  0  0
 43 82  1  0  0  0  0
 82 83  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014181-3D
FYIcenter.com

144150  0  0  1  0  0  0  0  0999 V2000
   -4.2441   -7.9154    5.9552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8054   -8.4163    5.9594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5459   -9.6925    5.1124 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.9122   -9.4629    3.6387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0693  -10.1967    5.2280 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1306   -9.1538    4.7056 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1037   -9.3802    4.1201 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5610  -10.4925    3.8577 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9282   -8.1018    3.8436 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.6917   -7.6782    5.1041 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4584   -6.3816    4.8847 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2448   -5.9569    6.0938 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4271   -6.2216    6.2844 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5079   -5.2142    6.9570 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8471   -8.3630    2.7155 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5880   -7.7832    1.4887 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6393   -7.0178    1.2907 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6009   -8.0796    0.3652 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.7633   -7.8059   -0.9649 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3534   -8.1303   -2.3353 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4979   -7.8097   -3.5368 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2716   -7.8023   -3.5206 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2316   -7.5702   -4.6492 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8869   -7.4116    0.3814 O   0  3  0  0  0  0  0  0  0  0  0  0
    5.9272   -7.7882   -0.5264 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8581   -8.9340   -1.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5474   -9.0132   -2.5781 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4779   -8.0435   -2.9262 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2721   -8.1085   -4.2059 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7582   -6.7227   -4.6611 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.6876   -6.7977   -5.7843 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3815   -7.3278   -7.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2723   -7.7388   -7.3343 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5009   -7.2740   -8.0713 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8368   -7.3845   -7.5216 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5922   -6.2750   -7.2223 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1176   -5.1443   -7.2573 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9841   -6.5535   -6.6879 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6342   -7.8155   -7.2659 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0082   -8.1404   -6.6897 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0019   -8.3047   -5.1702 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0098   -9.3469   -4.6671 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9616   -9.5927   -3.2336 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5826   -8.9805   -2.1755 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8870   -7.3583   -1.9720 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.8505   -9.8280   -1.1269 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.1425  -11.2014   -1.2019 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6592  -11.7910   -2.3764 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8079  -13.1724   -2.4881 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4515  -13.9453   -1.4003 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0412  -13.3493   -0.2236 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8957  -11.9840   -0.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7402  -14.3860    0.7494 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3032  -14.2031    1.8667 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0030  -15.5811    0.1506 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4277  -15.4337   -1.2351 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8007  -16.0446   -1.3924 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9036  -15.5916   -0.6412 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1767  -16.1255   -0.8428 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3530  -17.1261   -1.7882 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5800  -17.6680   -2.0257 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2794  -17.5995   -2.5296 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0069  -17.0585   -2.3330 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0154  -17.5796   -3.1246 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7343  -17.1143   -2.9831 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7761  -17.7426   -3.7854 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4519  -17.3318   -3.7214 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4813  -17.9131   -4.4794 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0676  -16.3024   -2.8781 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0238  -15.6817   -2.0746 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3722  -16.0866   -2.1088 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3791   -5.9788   -3.4624 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2850   -5.1515   -3.5326 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7776   -6.1489   -2.2425 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7687   -7.0697   -1.9861 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0428   -6.9657   -0.7946 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1159   -6.0980    1.3734 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.8010   -5.6064    1.8516 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2259   -6.5063    2.4597 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8430   -4.9027    0.5642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7626  -10.5748    6.7042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2229   -9.7950    7.4837 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1929  -11.7950    7.1273 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3249   -7.0321    6.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9300   -8.6761    6.3383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5708   -7.6133    4.9565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5343   -8.6089    7.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1719   -7.5919    5.6163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2049  -10.4826    5.4973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3118   -8.6613    3.1954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9651   -9.1891    3.5234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7521  -10.3728    3.0514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9125  -11.0986    4.6241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3933   -8.1923    4.8886 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2220   -7.3075    3.5690 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3907   -8.4698    5.3987 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9957   -7.5540    5.9435 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7946   -5.5635    4.5787 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1888   -6.5061    4.0851 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5630   -5.1216    6.7019 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2460   -9.2997    2.7522 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7817   -9.1633    0.3752 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4690   -6.7496   -0.9799 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8262   -8.3799   -0.8794 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5652   -9.1987   -2.4169 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2370   -7.5006   -2.4658 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2026   -7.6219   -4.5613 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1623   -9.7540   -1.1561 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3094   -9.8110   -3.2853 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6597   -8.5602   -4.9950 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1296   -8.7710   -4.0368 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9063   -6.1184   -4.9999 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5335   -6.2263   -5.7247 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4024   -6.3551   -8.6569 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3801   -8.1371   -8.7347 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2627   -8.3013   -7.5525 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8785   -6.6116   -5.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.6150   -5.6857   -6.9159 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7036   -7.7209   -8.3552 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0083   -8.6925   -7.0825 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7164   -7.3494   -6.9604 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.3705   -9.0660   -7.1538 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.7632   -7.3312   -4.7414 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0134   -8.5657   -4.8387 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2682  -10.3183   -5.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9798   -9.1367   -4.9665 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4949  -10.4546   -2.9794 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8926   -9.3849   -0.2161 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9678  -11.1758   -3.2198 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1795  -13.6137   -3.4085 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5332  -11.5604    0.8538 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.7825  -14.8018    0.0971 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.0104  -15.7450   -0.2603 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.2245  -17.2470   -1.4332 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.4347  -18.3844   -3.2647 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0843  -18.5452   -4.4455 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8814  -18.6509   -4.9645 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0295  -15.9978   -2.8494 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6946  -14.8878   -1.4082 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1478   -5.5203   -1.5379 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3620   -6.1455   -0.1675 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0660   -6.9333    2.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6372   -4.0082    0.9369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6136  -12.4257    6.5082 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 84  1  0  0  0  0
  1 85  1  0  0  0  0
  1 86  1  0  0  0  0
  2  3  1  0  0  0  0
  2 87  1  0  0  0  0
  2 88  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 89  1  0  0  0  0
  4 90  1  0  0  0  0
  4 91  1  0  0  0  0
  4 92  1  0  0  0  0
  5  6  1  0  0  0  0
  5 81  1  0  0  0  0
  5 93  1  0  0  0  0
  6  7  1  0  0  0  0
  6 94  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
  9 15  1  0  0  0  0
  9 95  1  0  0  0  0
 10 11  1  0  0  0  0
 10 96  1  0  0  0  0
 10 97  1  0  0  0  0
 11 12  1  0  0  0  0
 11 98  1  0  0  0  0
 11 99  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14100  1  0  0  0  0
 15 16  1  0  0  0  0
 15101  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 24  1  0  0  0  0
 18102  1  0  0  0  0
 19 20  1  0  0  0  0
 19103  1  0  0  0  0
 19104  1  0  0  0  0
 20 21  1  0  0  0  0
 20105  1  0  0  0  0
 20106  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23107  1  0  0  0  0
 24 25  1  0  0  0  0
 24 77  1  0  0  0  0
 25 26  1  0  0  0  0
 25 76  2  0  0  0  0
 26 27  2  0  0  0  0
 26108  1  0  0  0  0
 27 28  1  0  0  0  0
 27109  1  0  0  0  0
 28 29  1  0  0  0  0
 28 75  2  0  0  0  0
 29 30  1  0  0  0  0
 29110  1  0  0  0  0
 29111  1  0  0  0  0
 30 31  1  0  0  0  0
 30 72  1  0  0  0  0
 30112  1  0  0  0  0
 31 32  1  0  0  0  0
 31113  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34114  1  0  0  0  0
 34115  1  0  0  0  0
 35 36  1  0  0  0  0
 35116  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
 38 39  1  0  0  0  0
 38117  1  0  0  0  0
 38118  1  0  0  0  0
 39 40  1  0  0  0  0
 39119  1  0  0  0  0
 39120  1  0  0  0  0
 40 41  1  0  0  0  0
 40121  1  0  0  0  0
 40122  1  0  0  0  0
 41 42  1  0  0  0  0
 41123  1  0  0  0  0
 41124  1  0  0  0  0
 42 43  1  0  0  0  0
 42125  1  0  0  0  0
 42126  1  0  0  0  0
 43 44  1  0  0  0  0
 43127  1  0  0  0  0
 44 45  2  0  0  0  0
 44 46  1  0  0  0  0
 46 47  1  0  0  0  0
 46128  1  0  0  0  0
 47 48  1  0  0  0  0
 47 52  2  0  0  0  0
 48 49  2  0  0  0  0
 48129  1  0  0  0  0
 49 50  1  0  0  0  0
 49130  1  0  0  0  0
 50 51  2  0  0  0  0
 50 56  1  0  0  0  0
 51 52  1  0  0  0  0
 51 53  1  0  0  0  0
 52131  1  0  0  0  0
 53 54  2  0  0  0  0
 53 55  1  0  0  0  0
 55 56  1  0  0  0  0
 56 57  1  0  0  0  0
 56 71  1  0  0  0  0
 57 58  1  0  0  0  0
 57 63  2  0  0  0  0
 58 59  2  0  0  0  0
 58132  1  0  0  0  0
 59 60  1  0  0  0  0
 59133  1  0  0  0  0
 60 61  1  0  0  0  0
 60 62  2  0  0  0  0
 61134  1  0  0  0  0
 62 63  1  0  0  0  0
 62135  1  0  0  0  0
 63 64  1  0  0  0  0
 64 65  1  0  0  0  0
 65 66  1  0  0  0  0
 65 71  2  0  0  0  0
 66 67  2  0  0  0  0
 66136  1  0  0  0  0
 67 68  1  0  0  0  0
 67 69  1  0  0  0  0
 68137  1  0  0  0  0
 69 70  2  0  0  0  0
 69138  1  0  0  0  0
 70 71  1  0  0  0  0
 70139  1  0  0  0  0
 72 73  2  0  0  0  0
 72 74  1  0  0  0  0
 74 75  1  0  0  0  0
 74140  1  0  0  0  0
 75 76  1  0  0  0  0
 76141  1  0  0  0  0
 77 78  2  0  0  0  0
 77 79  1  0  0  0  0
 77 80  1  0  0  0  0
 79142  1  0  0  0  0
 80143  1  0  0  0  0
 81 82  2  0  0  0  0
 81 83  1  0  0  0  0
 83144  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-04-26, 1243👍, 0💬