Molecule FYI-1015507

A

Molecule Summary:

ID: FYI-1015507
Names:
InChIKey: QTMICXDMWJDQBK-ZHNQEOKUSA-N
SMILES: CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)NC(CCCCN)C(=O)O)[C@@H](C)O

Received at FYIcenter.com on: 2025-09-08

Molecule ID: FYI-1015507 Edit

Molecule Structure InChIKey: QTMICXDMWJDQBK-ZHNQEOKUSA-N

Molecule Structure SMILES String: CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)NC(CCCCN)C(=O)O)[C@@H](C)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1015507
FYIcenter.com

 92 92  0  0  1  0  0  0  0  0999 V2000
   38.7980    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   40.0104    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.2228    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.4352    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6478    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   42.4352    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   37.5855    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5855    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   36.3731    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   35.1607    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   35.1607    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3731    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.9483    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9483    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9483    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   14.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.0985    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   13.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.4612    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.2488    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2488    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4612    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  3 15  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  2  1  0  0  0  0
 10  9  2  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  6  0  0  0
 13 15  2  0  0  0  0
 14 12  1  0  0  0  0
 15 72  1  0  0  0  0
 14 16  1  1  0  0  0
 17 14  1  0  0  0  0
 18 12  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  1  0  0  0
 22 29  1  0  0  0  0
 23 21  1  0  0  0  0
 24 23  1  0  0  0  0
 25 21  1  0  0  0  0
 26 25  2  0  0  0  0
 27 25  1  0  0  0  0
 28 27  1  6  0  0  0
 29 36  1  0  0  0  0
 30 28  1  0  0  0  0
 31 30  1  0  0  0  0
 32 28  1  0  0  0  0
 33 32  2  0  0  0  0
 34 32  1  0  0  0  0
 35 34  1  1  0  0  0
 36 55  1  0  0  0  0
 37 35  1  0  0  0  0
 38 37  1  0  0  0  0
 39 37  1  0  0  0  0
 40 35  1  0  0  0  0
 41 40  2  0  0  0  0
 42 40  1  0  0  0  0
 43 42  1  6  0  0  0
 44 43  1  0  0  0  0
 45 44  1  0  0  0  0
 46 45  2  0  0  0  0
 47 46  1  0  0  0  0
 48 47  2  0  0  0  0
 49 48  1  0  0  0  0
 50 49  2  0  0  0  0
 50 45  1  0  0  0  0
 51 43  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 63  1  0  0  0  0
 56 54  1  0  0  0  0
 57 56  1  0  0  0  0
 58 56  1  0  0  0  0
 59 54  1  0  0  0  0
 60 59  2  0  0  0  0
 61 59  1  0  0  0  0
 62 61  1  6  0  0  0
 63 72  1  0  0  0  0
 64 62  1  0  0  0  0
 65 64  1  0  0  0  0
 66 65  2  0  0  0  0
 67 65  1  0  0  0  0
 68 62  1  0  0  0  0
 69 68  2  0  0  0  0
 70 68  1  0  0  0  0
 71 70  1  1  0  0  0
 72 79  1  0  0  0  0
 73 71  1  0  0  0  0
 74 73  1  0  0  0  0
 75 71  1  0  0  0  0
 76 75  2  0  0  0  0
 77 75  1  0  0  0  0
 78 77  1  1  0  0  0
 79 90  1  0  0  0  0
 80 78  1  0  0  0  0
 81 80  1  0  0  0  0
 82 81  1  0  0  0  0
 83 81  1  0  0  0  0
 84 78  1  0  0  0  0
 85 84  2  0  0  0  0
 86 84  1  0  0  0  0
 87 86  1  6  0  0  0
 88 90  2  0  0  0  0
 89 87  1  0  0  0  0
 90 87  1  0  0  0  0
 89 91  1  6  0  0  0
 92 89  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015507-3D
FYIcenter.com

185185  0  0  1  0  0  0  0  0999 V2000
  -15.6330   -0.1054  -12.9615 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1297   -0.3275  -12.6501 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.5100   -1.7302  -13.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3632   -0.0052  -11.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.7979    0.0544  -10.5451 C   0  0  2  0  0  0  0  0  0  0  0  0
  -18.7858    0.9687   -9.3583 N   0  0  0  0  0  0  0  0  0  0  0  0
  -18.7299    2.3603   -9.4866 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8602    2.9308  -10.5718 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4810    3.2303   -8.2264 C   0  0  2  0  0  0  0  0  0  0  0  0
  -18.5939    4.7428   -8.5747 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7923    5.1324   -9.6979 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1589    2.9355   -7.6372 N   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0106    2.2778   -6.4301 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.9482    1.9458   -5.7059 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5590    1.8604   -6.1196 C   0  0  2  0  0  0  0  0  0  0  0  0
  -15.0586    0.8026   -7.0863 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0050   -0.3623   -7.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0485   -0.3931   -7.6987 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6792   -1.3620   -6.2142 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5369    1.3239   -4.7650 N   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0805    2.1275   -3.7482 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5284    3.2056   -3.9544 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3313    1.5402   -2.3416 C   0  0  1  0  0  0  0  0  0  0  0  0
  -14.4747    2.2865   -1.4504 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0962    2.2919   -1.6282 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5107    1.5022   -2.3680 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3813    3.2135   -0.6268 C   0  0  2  0  0  0  0  0  0  0  0  0
  -11.1569    3.8777   -1.2252 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5027    4.8193   -2.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3481    5.9170   -2.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6172    6.8018   -3.1740 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0311    6.6070   -4.4217 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2205    5.4966   -4.6482 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9688    4.5968   -3.6174 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0006    2.3561    0.4632 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9993    1.8654    1.2358 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1375    2.3463    1.1967 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5509    0.7494    2.1800 C   0  0  1  0  0  0  0  0  0  0  0  0
  -11.5156    1.5177    3.0674 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2035    2.1129    3.2268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3496    1.9129    2.3620 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8047    3.2129    4.5863 C   0  0  2  0  0  0  0  0  0  0  0  0
   -9.9336    4.7374    4.3408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1664    5.1371    3.2202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4732    2.9795    5.1593 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1306    3.2156    6.4939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8949    3.7426    7.3173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6786    2.7658    6.8567 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.6558    3.7136    6.2023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6637    5.0192    6.7727 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4836    1.3296    6.5236 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1581    0.9214    5.1976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9965    1.7363    4.3117 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2868   -0.6224    4.9768 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.6059   -0.9372    4.3812 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7535   -0.4082    4.9133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7197    0.3423    5.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0891   -0.6808    4.2429 C   0  0  1  0  0  0  0  0  0  0  0  0
  -10.1959   -2.1284    3.8885 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2547   -0.1469    5.2382 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8263    1.4207    5.7089 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6996    2.8037    5.0361 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4922    3.4218    5.7378 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5280    3.3530    3.8016 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1900   -0.9979    3.9513 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7785   -0.6657    4.4296 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2863   -2.4035    3.6683 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9985    0.3296    2.8947 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8737   -0.4294    1.8770 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1468   -0.5044    4.1700 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.8388    1.6153   -1.9939 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1615    1.0016   -0.6324 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3858    3.0439   -2.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.4162   -1.3681  -10.1695 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.4391   -1.7900  -10.7133 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.7605   -2.1420   -9.2183 N   0  0  0  0  0  0  0  0  0  0  0  0
  -19.0303   -3.6038   -9.0069 C   0  0  2  0  0  0  0  0  0  0  0  0
  -19.9854   -3.9333   -7.8430 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6301   -4.4604   -6.7861 O   0  0  0  0  0  0  0  0  0  0  0  0
  -21.3055   -3.6146   -8.0571 N   0  0  0  0  0  0  0  0  0  0  0  0
  -22.2266   -3.8315   -6.9614 C   0  0  3  0  0  0  0  0  0  0  0  0
  -22.8032   -5.2837   -6.8484 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.9997   -6.6252   -6.9175 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.9728   -7.8204   -7.2187 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.4194   -9.2570   -7.1163 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.3916   -9.5814   -8.0987 N   0  0  0  0  0  0  0  0  0  0  0  0
  -21.8175   -2.8582   -5.8124 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.9184   -1.6396   -5.9447 O   0  0  0  0  0  0  0  0  0  0  0  0
  -21.1897   -3.3835   -4.7462 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7279   -4.4186   -8.7515 C   0  0  1  0  0  0  0  0  0  0  0  0
  -17.9392   -5.9417   -8.7434 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7609   -4.0940   -9.7595 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3947   -0.3450  -14.0043 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9976   -0.7299  -12.3228 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3528    0.9407  -12.7981 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6931    0.3912  -13.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1667   -2.5094  -12.4396 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0525   -1.9386  -14.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5901   -1.8243  -13.2649 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9372    1.0016  -11.0218 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7342   -0.6595  -10.5312 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.4733    0.5128  -11.2780 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.6408    0.5040   -8.4600 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.2586    2.9936   -7.4907 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6308    5.0154   -8.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.2688    5.3437   -7.7157 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3827    5.2882  -10.4605 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3659    2.9449   -8.2678 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9308    2.7555   -6.1916 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0079    1.1863   -8.1124 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0460    0.4722   -6.8312 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8595   -1.2262   -5.6918 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3541    0.7633   -4.5305 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9937    0.4949   -2.3359 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8156    2.5794   -0.5333 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0902    3.9725   -0.2577 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6257    4.4482   -0.4504 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4480    3.1126   -1.5691 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8049    6.1010   -1.1653 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2803    7.6436   -3.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2148    7.3175   -5.2203 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7865    5.3261   -5.6274 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3655    3.7124   -3.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1147    1.8528    0.4190 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0780   -0.0877    1.6487 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9922    1.3044    3.8897 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4509    3.1171    5.4385 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9624    5.0720    4.1972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5816    5.3028    5.2217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6718    4.3565    2.9143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8372    2.3984    4.6303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5742    2.8136    7.9486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6407    3.3141    6.3022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8529    3.8527    5.1365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6572    4.9477    7.7416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1635    0.7266    6.9662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1929   -1.1987    5.9060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6569   -1.8276    3.8915 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0949   -0.2380    3.2517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8821   -2.7244    4.6524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5780   -2.3304    3.0923 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9916   -0.5783    6.2134 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0969   -0.7341    4.9385 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0814    1.7871    6.4159 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6483    1.1255    6.3663 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0154    3.0701    3.0142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3672   -0.4796    2.9986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5527   -1.1832    5.3669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6405    0.4092    4.5871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0370   -0.9922    3.6933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8820   -2.8897    4.4071 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5240    1.2613    3.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3517   -1.3211    1.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1233    0.1876    1.0196 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8285   -0.7501    2.3173 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6539   -1.4763    4.0836 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.2000   -0.7273    4.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8462    0.0450    5.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3945    1.0249   -2.7341 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7022    1.5679    0.1824 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.8194   -0.0370   -0.5818 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.2428    0.9998   -0.4556 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.8843    3.6970   -1.3382 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4581    3.0554   -1.8382 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2578    3.4733   -3.0574 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0238   -1.7105   -8.6576 H   0  0  0  0  0  0  0  0  0  0  0  0
  -19.4943   -3.9744   -9.9299 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.4268   -2.7469   -8.5821 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.1363   -3.3016   -7.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.4669   -5.3520   -7.7245 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.4594   -5.3314   -5.9718 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.4933   -6.8103   -5.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.2434   -6.5966   -7.7081 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.3985   -7.6909   -8.2235 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.8206   -7.7636   -6.5229 H   0  0  0  0  0  0  0  0  0  0  0  0
  -23.2478   -9.9651   -7.2647 H   0  0  0  0  0  0  0  0  0  0  0  0
  -22.0321   -9.4424   -6.1095 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.7934   -9.5707   -9.0356 H   0  0  0  0  0  0  0  0  0  0  0  0
  -21.0786  -10.5431   -7.9498 H   0  0  0  0  0  0  0  0  0  0  0  0
  -20.8148   -4.2661   -4.9363 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2854   -4.1225   -7.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5382   -6.2642   -9.6017 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4440   -6.2942   -7.8373 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9803   -6.4669   -8.8047 H   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0775   -4.4859  -10.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 93  1  0  0  0  0
  1 94  1  0  0  0  0
  1 95  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 96  1  0  0  0  0
  3 97  1  0  0  0  0
  3 98  1  0  0  0  0
  3 99  1  0  0  0  0
  4100  1  0  0  0  0
  4101  1  0  0  0  0
  5 74  1  0  0  0  0
  5  6  1  0  0  0  0
  5  4  1  0  0  0  0
  5102  1  6  0  0  0
  6  7  1  0  0  0  0
  6103  1  0  0  0  0
  7  8  2  0  0  0  0
  9 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9  7  1  0  0  0  0
  9104  1  1  0  0  0
 10 11  1  0  0  0  0
 10105  1  0  0  0  0
 10106  1  0  0  0  0
 11107  1  0  0  0  0
 12 13  1  0  0  0  0
 12108  1  0  0  0  0
 13 14  2  0  0  0  0
 15 20  1  0  0  0  0
 15 16  1  0  0  0  0
 15 13  1  0  0  0  0
 15109  1  6  0  0  0
 16 17  1  0  0  0  0
 16110  1  0  0  0  0
 16111  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19112  1  0  0  0  0
 20 21  1  0  0  0  0
 20113  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 71  1  0  0  0  0
 23114  1  1  0  0  0
 24 25  1  0  0  0  0
 24115  1  0  0  0  0
 25 26  2  0  0  0  0
 27 35  1  0  0  0  0
 27 28  1  0  0  0  0
 27 25  1  0  0  0  0
 27116  1  1  0  0  0
 28 29  1  0  0  0  0
 28117  1  0  0  0  0
 28118  1  0  0  0  0
 29 30  1  0  0  0  0
 29 34  2  0  0  0  0
 30 31  2  0  0  0  0
 30119  1  0  0  0  0
 31 32  1  0  0  0  0
 31120  1  0  0  0  0
 32 33  2  0  0  0  0
 32121  1  0  0  0  0
 33 34  1  0  0  0  0
 33122  1  0  0  0  0
 34123  1  0  0  0  0
 35 36  1  0  0  0  0
 35124  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
 38 68  1  0  0  0  0
 38125  1  6  0  0  0
 39 40  1  0  0  0  0
 39126  1  0  0  0  0
 40 41  2  0  0  0  0
 42 45  1  0  0  0  0
 42 43  1  0  0  0  0
 42 40  1  0  0  0  0
 42127  1  1  0  0  0
 43 44  1  0  0  0  0
 43128  1  0  0  0  0
 43129  1  0  0  0  0
 44130  1  0  0  0  0
 45 46  1  0  0  0  0
 45131  1  0  0  0  0
 46 47  2  0  0  0  0
 48 51  1  0  0  0  0
 48 49  1  0  0  0  0
 48 46  1  0  0  0  0
 48132  1  1  0  0  0
 49 50  1  0  0  0  0
 49133  1  0  0  0  0
 49134  1  0  0  0  0
 50135  1  0  0  0  0
 51 52  1  0  0  0  0
 51136  1  0  0  0  0
 52 53  2  0  0  0  0
 52 54  1  0  0  0  0
 54 55  1  0  0  0  0
 54 65  1  0  0  0  0
 54137  1  1  0  0  0
 55 56  1  0  0  0  0
 55138  1  0  0  0  0
 56 57  2  0  0  0  0
 56 58  1  0  0  0  0
 58 59  1  0  0  0  0
 58 60  1  0  0  0  0
 58139  1  6  0  0  0
 59140  1  0  0  0  0
 59141  1  0  0  0  0
 60 61  1  0  0  0  0
 60142  1  0  0  0  0
 60143  1  0  0  0  0
 61 62  1  0  0  0  0
 61144  1  0  0  0  0
 61145  1  0  0  0  0
 62 63  2  0  0  0  0
 62 64  1  0  0  0  0
 64146  1  0  0  0  0
 65 66  1  0  0  0  0
 65 67  1  0  0  0  0
 65147  1  6  0  0  0
 66148  1  0  0  0  0
 66149  1  0  0  0  0
 66150  1  0  0  0  0
 67151  1  0  0  0  0
 68 69  1  0  0  0  0
 68 70  1  0  0  0  0
 68152  1  0  0  0  0
 69153  1  0  0  0  0
 69154  1  0  0  0  0
 69155  1  0  0  0  0
 70156  1  0  0  0  0
 70157  1  0  0  0  0
 70158  1  0  0  0  0
 71 72  1  0  0  0  0
 71 73  1  0  0  0  0
 71159  1  0  0  0  0
 72160  1  0  0  0  0
 72161  1  0  0  0  0
 72162  1  0  0  0  0
 73163  1  0  0  0  0
 73164  1  0  0  0  0
 73165  1  0  0  0  0
 74 75  2  0  0  0  0
 74 76  1  0  0  0  0
 76166  1  0  0  0  0
 77 90  1  0  0  0  0
 77 78  1  0  0  0  0
 77 76  1  0  0  0  0
 77167  1  6  0  0  0
 78 79  2  0  0  0  0
 78 80  1  0  0  0  0
 80 81  1  0  0  0  0
 80168  1  0  0  0  0
 81 82  1  0  0  0  0
 81 87  1  0  0  0  0
 81169  1  0  0  0  0
 82 83  1  0  0  0  0
 82170  1  0  0  0  0
 82171  1  0  0  0  0
 83 84  1  0  0  0  0
 83172  1  0  0  0  0
 83173  1  0  0  0  0
 84 85  1  0  0  0  0
 84174  1  0  0  0  0
 84175  1  0  0  0  0
 85 86  1  0  0  0  0
 85176  1  0  0  0  0
 85177  1  0  0  0  0
 86178  1  0  0  0  0
 86179  1  0  0  0  0
 87 88  2  0  0  0  0
 87 89  1  0  0  0  0
 89180  1  0  0  0  0
 90 91  1  0  0  0  0
 90 92  1  0  0  0  0
 90181  1  1  0  0  0
 91182  1  0  0  0  0
 91183  1  0  0  0  0
 91184  1  0  0  0  0
 92185  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-09-24, 620👍, 0💬