RDKit 3D 90 91 0 0 0 0 0 0 0 0999 V2000 5.1551 -1.3538 1.7663 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7661 -1.1153 0.4169 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8631 -2.1856 0.2663 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -1.2996 -0.7252 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6351 -0.4436 -0.7838 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7526 -0.5465 0.2875 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1052 -1.6389 0.7676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9512 -1.7652 2.0337 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5623 -2.7014 -0.0967 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -3.7864 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1161 -4.4688 -0.0528 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5128 -4.4717 0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1194 -5.5705 0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3582 -3.2812 0.4396 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0834 -2.8749 1.8388 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1791 -2.2392 -0.5633 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9619 -2.8150 -1.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1892 -0.8442 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.2953 -0.7845 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1896 0.0602 0.1668 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5747 -0.6015 0.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -1.0220 -1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5593 0.4401 0.7699 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8411 0.8255 1.3323 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1976 0.2196 2.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2108 2.0992 1.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5273 2.8346 2.3251 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2509 2.6561 0.3837 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5143 4.1779 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3188 4.8372 1.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8847 4.3924 -0.2423 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 2.4301 0.8315 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 2.5332 0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 3.2927 0.5294 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5882 1.8685 -1.2188 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9013 2.4860 -2.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.9199 -3.3526 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1604 3.1063 -2.3618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0002 1.9301 -1.5377 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9596 0.9880 -1.0918 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1728 1.3102 -0.9246 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7342 -2.3934 1.8371 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0084 -1.3594 2.5066 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4653 -0.5818 2.1043 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3122 -0.1668 0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -1.8986 -0.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5359 -2.0625 1.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4034 -3.1739 0.2163 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4363 -1.0687 -1.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5612 -2.3576 -0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0557 -0.7927 -1.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3326 -3.2100 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7995 -2.2625 -0.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5468 -3.4074 1.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7199 -4.5056 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3021 -5.0238 -0.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -3.5889 0.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7137 -3.7795 2.3868 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -2.6556 2.3481 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -2.0285 1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 -3.7690 -1.8842 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4234 -2.1423 -2.5721 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0006 -2.9337 -2.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4279 0.8356 -0.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5523 -1.5186 0.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0789 -0.7484 -1.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9727 -2.1294 -1.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4262 -0.4714 -1.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2002 0.8168 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2521 0.0499 1.5481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0262 1.3533 1.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0345 -0.4861 2.5114 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5672 1.0064 3.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3729 -0.2646 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4077 2.3547 -0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 4.5662 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 5.8190 1.4878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7158 4.2813 2.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3142 5.1305 2.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6104 4.7896 0.4997 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8505 5.0413 -1.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3248 3.4253 -0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2266 2.1606 1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3391 0.7883 -1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3074 3.3682 -2.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2642 1.7595 -2.9397 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 3.8625 -3.8531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 2.1065 -4.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9283 4.0373 -1.8122 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1367 3.1411 -2.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 20 24 1 0 24 25 1 0 24 26 1 0 26 27 2 0 26 28 1 0 28 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 28 29 1 0 29 30 1 0 29 31 1 0 40 5 1 0 39 35 1 0 1 42 1 0 1 43 1 0 1 44 1 0 2 45 1 0 3 46 1 0 3 47 1 0 3 48 1 0 4 49 1 0 4 50 1 0 5 51 1 6 9 52 1 0 9 53 1 0 10 54 1 0 10 55 1 0 11 56 1 0 14 57 1 1 15 58 1 0 15 59 1 0 15 60 1 0 17 61 1 0 17 62 1 0 17 63 1 0 20 64 1 6 21 65 1 0 22 66 1 0 22 67 1 0 22 68 1 0 23 69 1 0 23 70 1 0 23 71 1 0 25 72 1 0 25 73 1 0 25 74 1 0 28 75 1 6 32 83 1 0 35 84 1 1 36 85 1 0 36 86 1 0 37 87 1 0 37 88 1 0 38 89 1 0 38 90 1 0 29 76 1 0 30 77 1 0 30 78 1 0 30 79 1 0 31 80 1 0 31 81 1 0 31 82 1 0 M END