| 6XHT_V2V_E_301 |
| RDKit 3D |
|
|
| 59 60 0 0 0 0 0 0 0 0999 V2000 |
| -8.0474 -0.0183 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.0125 -0.8458 0.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5676 0.6496 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.7868 1.2150 -0.5427 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.6768 -1.4865 0.0037 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| -3.9608 -1.9718 -1.2631 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -2.6613 -2.4726 -0.6446 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -2.3799 -1.3922 0.4087 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -1.5560 -0.2305 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.3110 0.6868 1.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.7568 0.4423 0.7296 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 5.8690 0.3863 -0.8131 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 7.3038 0.2287 -1.3658 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| 7.9953 -1.0927 -1.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.7809 -0.5492 -0.1956 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6303 1.5073 -1.0478 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.7971 2.1167 -0.7354 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.4693 0.9412 -1.3563 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.6744 -0.8972 0.8495 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.1226 0.5991 0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.2908 2.6664 1.7316 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.3958 2.3499 -0.7171 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.3201 0.7994 0.2189 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.6737 -0.2996 2.6022 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.4441 -1.6796 0.4077 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.4967 -0.3918 0.7413 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2287 -2.2156 -1.4478 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.0810 1.3667 -0.9557 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.3516 1.6173 -1.3562 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.2093 -0.7749 1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.8761 -3.7338 0.0108 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.6676 -2.9654 -1.9932 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.0551 1.6551 0.6607 P 0 0 2 0 0 0 0 0 0 0 0 0 |
| 1.9382 -0.3344 1.1373 P 0 0 1 0 0 0 0 0 0 0 0 0 |
| -9.0293 -0.2158 0.6235 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.1152 -1.7781 0.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.0666 -2.3611 0.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.7240 -1.1651 -1.9581 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8623 -2.6163 -1.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8849 -1.8070 1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.1432 0.3829 -0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.6840 -0.6108 -0.6924 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.9192 1.6320 0.8073 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.2719 0.7069 2.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.3799 1.2562 1.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.2492 -0.4290 -1.2036 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2339 0.2940 -2.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.1974 -1.1794 0.0592 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.9783 -1.1394 -1.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -9.4714 2.2127 0.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.4427 3.0121 -1.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.0837 3.0226 -0.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.9450 -1.8125 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2754 -2.2475 -2.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.9963 1.2219 -1.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.0777 2.2687 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.5083 -1.4399 1.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.0257 -4.0145 0.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5039 -2.5633 -2.2814 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 1 |
| 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 1 |
| 9 41 1 0 |
| 9 42 1 0 |
| 10 43 1 0 |
| 10 44 1 0 |
| 11 45 1 1 |
| 12 46 1 6 |
| 13 47 1 6 |
| 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 |
| $$$$ |
|
|
