| 6ZAE_ACV_A_403 |
| RDKit 3D |
|
|
| 49 48 0 0 0 0 0 0 0 0999 V2000 |
| 5.9719 -1.1571 1.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.7989 -0.1215 0.7978 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 4.5172 -0.3969 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.2481 0.6392 -1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8731 0.4506 -1.7404 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.7360 0.9269 -0.8559 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.4946 0.5860 -1.3359 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.7199 0.8396 -0.5557 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| -1.8124 -0.0873 -1.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.9877 -0.1362 -0.0836 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.8910 1.5818 0.1695 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.1304 2.3174 -0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.0875 2.8375 0.8464 S 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.5772 -0.8779 -2.0465 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2250 -1.1524 2.4383 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.1237 -1.8988 2.3887 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.0480 0.0128 -0.5362 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.1189 -0.9475 -0.8264 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -3.9402 -2.0915 0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5048 -0.2850 -0.6781 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| -6.6437 -1.2688 -0.9673 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.6426 0.9227 -1.6139 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.5582 -1.9820 1.3325 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.2721 -3.2985 -0.3226 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.7289 0.8580 1.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5625 -1.3985 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.6710 -0.4184 0.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.3406 1.6526 -0.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.0075 0.5382 -1.8831 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8280 1.0389 -2.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.7161 -0.6019 -2.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.4162 -0.1144 -2.0706 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.5087 0.5193 0.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.0250 0.7381 -0.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.8136 -0.1400 0.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.2570 2.9751 -0.6746 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.7384 2.5143 -1.5114 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.0578 2.8008 1.7092 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.1873 -1.8522 3.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.0882 0.4693 0.3719 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.9760 -1.3402 -1.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.6256 0.0741 0.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.5423 -1.7116 -1.9641 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6668 -2.0794 -0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.6151 -0.7645 -0.9191 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6367 1.3740 -1.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.9109 1.7008 -1.3736 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.4984 0.6306 -2.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.0858 -3.9227 0.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1 2 1 0 |
| 2 3 1 0 |
| 3 4 1 0 |
| 4 5 1 0 |
| 5 6 1 0 |
| 6 7 1 0 |
| 7 8 1 0 |
| 8 9 1 0 |
| 2 10 1 0 |
| 6 11 2 0 |
| 8 12 1 0 |
| 12 13 1 0 |
| 9 14 2 0 |
| 1 15 1 0 |
| 1 16 2 0 |
| 9 17 1 0 |
| 18 17 1 0 |
| 18 19 1 0 |
| 18 20 1 0 |
| 20 21 1 0 |
| 20 22 1 0 |
| 19 23 2 0 |
| 19 24 1 0 |
| 2 25 1 1 |
| 3 26 1 0 |
| 3 27 1 0 |
| 4 28 1 0 |
| 4 29 1 0 |
| 5 30 1 0 |
| 5 31 1 0 |
| 7 32 1 0 |
| 8 33 1 1 |
| 10 34 1 0 |
| 10 35 1 0 |
| 12 36 1 0 |
| 12 37 1 0 |
| 13 38 1 0 |
| 15 39 1 0 |
| 17 40 1 0 |
| 18 41 1 6 |
| 20 42 1 6 |
| 21 43 1 0 |
| 21 44 1 0 |
| 21 45 1 0 |
| 22 46 1 0 |
| 22 47 1 0 |
| 22 48 1 0 |
| 24 49 1 0 |
| M END |
| $$$$ |
|
|
