| 6XHT_V2V_E_301 |
| RDKit 3D |
|
|
| 59 60 0 0 0 0 0 0 0 0999 V2000 |
| -8.1584 0.7291 1.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.1960 -0.1704 0.9187 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.8140 1.4473 -0.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.9060 2.0676 0.5436 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.9867 -0.8602 0.1257 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| -4.4429 -1.1220 -1.2846 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -3.1125 -1.7784 -0.9351 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -2.6674 -0.9610 0.2845 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -1.7727 0.2294 -0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8102 -0.2099 -1.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1153 -0.6094 -0.4391 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 6.9587 0.5617 0.1021 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 6.2771 1.3653 1.2286 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 5.4768 2.5835 0.7523 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.0382 0.1485 0.2415 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.8173 2.3783 -0.0827 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.8527 3.0465 0.6656 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7603 1.7624 -0.7734 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.8641 -0.4870 0.9467 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.6114 -0.1396 -0.8037 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.0647 -2.5884 -0.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.8155 -0.5165 1.2394 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.7429 -1.0057 -1.0352 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2627 -2.1613 0.7194 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.5791 -3.3277 -1.4982 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.1753 -1.3966 -1.6116 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.7754 3.1299 1.8735 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2694 1.8899 2.1412 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.3399 1.4094 -0.9905 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.9357 -1.3066 -1.4017 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.3035 -3.1430 -0.5312 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.2914 -1.9328 -2.0923 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.4255 -1.1783 -0.1617 P 0 0 2 0 0 0 0 0 0 0 0 0 |
| 2.9625 -1.9780 -0.7335 P 0 0 1 0 0 0 0 0 0 0 0 0 |
| -9.0719 0.5250 1.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.2938 -1.1795 1.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.3753 -1.8053 0.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.2356 -0.2058 -1.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.4111 -1.7825 -1.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.1508 -1.5982 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3227 0.9533 -0.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.4777 0.7679 0.8326 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.0079 0.4162 -2.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.1339 0.3260 -0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.9095 -1.3226 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.9018 0.1445 0.4839 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.6482 0.7068 1.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1291 3.3730 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.7372 2.3383 -0.0112 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -9.8223 2.7585 0.6509 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.6629 3.8375 0.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.3710 -1.0971 1.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.9282 -3.8721 -1.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.4702 3.3120 2.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.8164 1.1489 2.4517 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.7731 0.8135 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.3433 -1.9357 -1.8599 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.4137 -3.5178 -0.3837 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.0805 -1.4023 -2.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1 2 2 0 |
| 1 4 1 0 |
| 5 6 1 0 |
| 6 7 1 0 |
| 7 8 1 0 |
| 8 9 1 0 |
| 10 11 1 0 |
| 11 12 1 0 |
| 12 13 1 0 |
| 13 14 1 0 |
| 2 15 1 0 |
| 3 15 1 0 |
| 5 15 1 0 |
| 3 16 1 0 |
| 4 16 2 0 |
| 4 17 1 0 |
| 3 18 2 0 |
| 5 19 1 0 |
| 8 19 1 0 |
| 9 20 1 0 |
| 10 26 1 0 |
| 14 27 1 0 |
| 13 28 1 0 |
| 12 29 1 0 |
| 11 30 1 0 |
| 7 31 1 0 |
| 6 32 1 0 |
| 33 20 1 6 |
| 21 33 2 0 |
| 33 22 1 0 |
| 23 33 1 0 |
| 34 23 1 1 |
| 24 34 2 0 |
| 34 25 1 0 |
| 26 34 1 0 |
| 1 35 1 0 |
| 2 36 1 0 |
| 5 37 1 1 |
| 6 38 1 6 |
| 7 39 1 6 |
| 8 40 1 1 |
| 9 41 1 0 |
| 9 42 1 0 |
| 10 43 1 0 |
| 10 44 1 0 |
| 11 45 1 1 |
| 12 46 1 1 |
| 13 47 1 1 |
| 14 48 1 0 |
| 14 49 1 0 |
| 17 50 1 0 |
| 17 51 1 0 |
| 22 52 1 0 |
| 25 53 1 0 |
| 27 54 1 0 |
| 28 55 1 0 |
| 29 56 1 0 |
| 30 57 1 0 |
| 31 58 1 0 |
| 32 59 1 0 |
| M END |
| $$$$ |
|
|
