| 6e6j_ligand |
| -I-interpret- |
|
|
| 65 68 0 0 0 0 0 0 0 0999 V2000 |
| 23.9150 -8.7110 -4.3290 N 0 0 0 0 0 |
| 21.7690 -9.3450 -7.8820 C 0 0 0 0 0 |
| 22.4870 -9.4020 -6.6590 C 0 0 0 0 0 |
| 22.7360 -10.3770 -5.6160 C 0 0 0 0 0 |
| 23.4170 -9.9760 -4.5020 C 0 0 0 0 0 |
| 24.6430 -8.3710 -3.1060 C 0 0 0 0 0 |
| 22.9930 -8.1120 -6.4370 C 0 0 0 0 0 |
| 22.4910 -14.1820 -5.6930 C 0 0 0 0 0 |
| 20.2900 -13.2420 -6.0560 C 0 0 0 0 0 |
| 18.6100 -10.9120 -6.0930 C 0 0 0 0 0 |
| 16.5640 -10.8750 -4.8600 C 0 0 0 0 0 |
| 15.9080 -11.0930 -6.0490 C 0 0 0 0 0 |
| 16.5490 -11.2200 -7.2580 C 0 0 0 0 0 |
| 18.6620 -11.2020 -8.6240 C 0 0 0 0 0 |
| 23.1240 -16.2470 -4.3620 C 0 0 0 0 0 |
| 21.2240 -6.2600 -9.7990 N 0 0 0 0 0 |
| 21.0530 -4.1920 -11.0910 C 0 0 0 0 0 |
| 20.6520 -8.3620 -10.3620 O 0 0 0 0 0 |
| 20.6400 -5.6290 -10.9790 C 0 0 0 0 0 |
| 22.1810 -11.7540 -5.7340 C 0 0 0 0 0 |
| 23.0020 -12.8850 -5.6000 C 0 0 0 0 0 |
| 21.1240 -14.3370 -5.9150 C 0 0 0 0 0 |
| 20.8140 -11.9550 -5.9680 C 0 0 0 0 0 |
| 17.9520 -10.7620 -4.8620 C 0 0 0 0 0 |
| 18.6820 -10.3890 -3.5980 C 0 0 0 0 0 |
| 21.1680 -7.5730 -9.5760 C 0 0 0 0 0 |
| 17.9370 -11.1290 -7.3040 C 0 0 0 0 0 |
| 23.3970 -15.4130 -5.6120 C 0 0 0 0 0 |
| 23.2540 -16.2780 -6.8620 C 0 0 0 0 0 |
| 21.8320 -8.0620 -8.3570 C 0 0 0 0 0 |
| 23.7520 -7.6960 -5.2860 C 0 0 0 0 0 |
| 14.5510 -11.1800 -6.0280 F 0 0 0 0 0 |
| 22.5800 -7.3160 -7.4780 N 0 0 0 0 0 |
| 24.2540 -6.5880 -5.1030 O 0 0 0 0 0 |
| 19.9970 -10.8260 -6.1160 O 0 0 0 0 0 |
| 24.7840 -15.0170 -5.5400 O 0 0 0 0 0 |
| 21.2557 -10.1789 -8.3608 H 0 0 0 0 0 |
| 23.5732 -10.7034 -3.7054 H 0 0 0 0 0 |
| 25.6523 -8.0495 -3.3630 H 0 0 0 0 0 |
| 24.1241 -7.5643 -2.5882 H 0 0 0 0 0 |
| 24.6930 -9.2468 -2.4591 H 0 0 0 0 0 |
| 19.2247 -13.3866 -6.2356 H 0 0 0 0 0 |
| 16.0047 -10.7917 -3.9281 H 0 0 0 0 0 |
| 15.9770 -11.3900 -8.1702 H 0 0 0 0 0 |
| 19.1847 -10.2623 -8.8025 H 0 0 0 0 0 |
| 19.3818 -12.0201 -8.5970 H 0 0 0 0 0 |
| 17.9418 -11.3762 -9.4235 H 0 0 0 0 0 |
| 23.7802 -17.1173 -4.3570 H 0 0 0 0 0 |
| 23.3133 -15.6425 -3.4750 H 0 0 0 0 0 |
| 22.0843 -16.5743 -4.3651 H 0 0 0 0 0 |
| 21.6962 -5.6695 -9.1144 H 0 0 0 0 0 |
| 20.7192 -3.6494 -10.2066 H 0 0 0 0 0 |
| 22.1387 -4.1322 -11.1673 H 0 0 0 0 0 |
| 20.6003 -3.7534 -11.9803 H 0 0 0 0 0 |
| 19.5542 -5.6717 -10.8931 H 0 0 0 0 0 |
| 20.9895 -6.1599 -11.8645 H 0 0 0 0 0 |
| 24.0679 -12.7473 -5.4183 H 0 0 0 0 0 |
| 20.7035 -15.3406 -5.9788 H 0 0 0 0 0 |
| 19.4347 -11.1460 -3.3778 H 0 0 0 0 0 |
| 19.1661 -9.4215 -3.7315 H 0 0 0 0 0 |
| 17.9716 -10.3305 -2.7734 H 0 0 0 0 0 |
| 23.5386 -15.6967 -7.7390 H 0 0 0 0 0 |
| 23.9033 -17.1492 -6.7756 H 0 0 0 0 0 |
| 22.2184 -16.6034 -6.9606 H 0 0 0 0 0 |
| 25.3370 -15.8001 -5.4898 H 0 0 0 0 0 |
| 5 1 1 0 0 0 |
| 1 6 1 0 0 0 |
| 31 1 1 0 0 0 |
| 2 3 4 0 0 0 |
| 30 2 4 0 0 0 |
| 3 4 1 0 0 0 |
| 3 7 4 0 0 0 |
| 4 5 2 0 0 0 |
| 4 20 1 0 0 0 |
| 7 31 1 0 0 0 |
| 7 33 4 0 0 0 |
| 21 8 4 0 0 0 |
| 8 22 4 0 0 0 |
| 8 28 1 0 0 0 |
| 9 22 4 0 0 0 |
| 23 9 4 0 0 0 |
| 10 24 4 0 0 0 |
| 10 27 4 0 0 0 |
| 35 10 1 0 0 0 |
| 11 12 4 0 0 0 |
| 24 11 4 0 0 0 |
| 13 12 4 0 0 0 |
| 12 32 1 0 0 0 |
| 27 13 4 0 0 0 |
| 27 14 1 0 0 0 |
| 28 15 1 0 0 0 |
| 16 19 1 0 0 0 |
| 26 16 1 0 0 0 |
| 19 17 1 0 0 0 |
| 26 18 2 0 0 0 |
| 20 21 4 0 0 0 |
| 20 23 4 0 0 0 |
| 23 35 1 0 0 0 |
| 24 25 1 0 0 0 |
| 26 30 1 0 0 0 |
| 28 29 1 0 0 0 |
| 28 36 1 0 0 0 |
| 30 33 4 0 0 0 |
| 31 34 2 0 0 0 |
| 2 37 1 0 0 0 |
| 5 38 1 0 0 0 |
| 6 39 1 0 0 0 |
| 6 40 1 0 0 0 |
| 6 41 1 0 0 0 |
| 9 42 1 0 0 0 |
| 11 43 1 0 0 0 |
| 13 44 1 0 0 0 |
| 14 45 1 0 0 0 |
| 14 46 1 0 0 0 |
| 14 47 1 0 0 0 |
| 15 48 1 0 0 0 |
| 15 49 1 0 0 0 |
| 15 50 1 0 0 0 |
| 16 51 1 0 0 0 |
| 17 52 1 0 0 0 |
| 17 53 1 0 0 0 |
| 17 54 1 0 0 0 |
| 19 55 1 0 0 0 |
| 19 56 1 0 0 0 |
| 21 57 1 0 0 0 |
| 22 58 1 0 0 0 |
| 25 59 1 0 0 0 |
| 25 60 1 0 0 0 |
| 25 61 1 0 0 0 |
| 29 62 1 0 0 0 |
| 29 63 1 0 0 0 |
| 29 64 1 0 0 0 |
| 36 65 1 0 0 0 |
| M END |
| $$$$ |
|
|
