| 6XHT_V2V_E_301 |
| RDKit 3D |
|
|
| 59 60 0 0 0 0 0 0 0 0999 V2000 |
| -7.6827 -0.2004 1.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.7627 -1.0450 0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.7759 0.6778 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.6094 1.1781 0.8946 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7719 -1.5832 -0.3699 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| -4.4619 -1.7186 -1.8744 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -3.0735 -1.1131 -2.0172 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -2.4788 -1.3206 -0.6237 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -1.3998 -0.3000 -0.2768 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.3447 1.5733 1.2918 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.1851 0.9487 0.1621 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 5.6958 -0.4833 0.4972 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 6.3958 -1.2305 -0.6606 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 7.6766 -0.5789 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.8203 -0.6420 0.0238 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.7208 1.5668 0.0348 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.5095 2.1116 1.3299 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.9223 1.0449 -1.2295 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.5562 -1.2174 0.3165 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.2429 -0.5045 -1.0756 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.3646 -0.4745 -1.2899 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1870 -1.4394 0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1089 1.0490 0.4206 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.7381 2.7532 2.2899 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.0905 0.2978 2.7967 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2867 0.7197 1.7024 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.3464 0.5346 -2.0245 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.4870 -1.3736 -1.7735 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.6052 -1.3511 0.8866 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.2634 1.8560 -0.0636 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3282 -1.7850 -3.0408 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.4000 -3.1080 -2.2391 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1922 -0.3073 -0.3868 P 0 0 2 0 0 0 0 0 0 0 0 0 |
| 1.8107 1.3411 1.8138 P 0 0 1 0 0 0 0 0 0 0 0 0 |
| -8.4258 -0.4678 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.7252 -2.0731 1.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.0411 -2.5774 0.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.2047 -1.2623 -2.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.1320 -0.0518 -2.2775 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.0530 -2.3305 -0.5506 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.1602 -0.3822 0.7896 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.7566 0.7229 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.9795 1.7620 2.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.9656 2.5491 0.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5582 0.9087 -0.7361 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.3906 -0.4277 1.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.6311 -2.2474 -0.3166 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.2426 -1.2915 -1.7951 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.3223 -0.2382 -0.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -9.4546 1.7984 1.5153 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.4796 2.9697 0.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.6203 -2.2432 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1035 -0.6182 2.4377 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.7533 0.1414 -2.6996 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.6336 -1.6417 -1.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.0959 -0.8554 1.5575 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.6697 1.6240 -0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.5089 -1.2637 -3.1807 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.7260 -3.1511 -2.9517 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 6 |
| 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 6 |
| 9 41 1 0 |
| 9 42 1 0 |
| 10 43 1 0 |
| 10 44 1 0 |
| 11 45 1 6 |
| 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 |
| $$$$ |
|
|
