RDKit 3D 125127 0 0 0 0 0 0 0 0999 V2000 2.3966 -5.4571 -1.7167 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6111 -4.1373 -1.7591 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3871 -3.6234 -0.3617 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7317 -3.3991 0.2616 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4668 -2.4241 -0.2746 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4423 -2.0196 1.1206 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -0.9795 1.7416 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1107 -1.0528 3.0515 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8518 0.1484 1.1383 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0588 -0.1627 0.4459 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 0.1387 1.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3539 0.6820 2.1464 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5642 -0.1317 0.3853 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8161 0.1852 1.0083 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5614 1.3142 0.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9355 1.1381 -1.0519 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8329 -0.0439 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7419 2.3817 -1.4538 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6633 -0.9925 1.2406 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2346 -2.1313 0.8822 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9039 -0.9559 1.8255 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9495 1.0612 0.3358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 2.1232 -0.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1707 3.4668 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3204 3.4044 -0.3657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0735 3.6473 0.8451 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4758 3.5016 0.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9766 3.0054 1.9554 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3602 3.8999 -0.1803 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5282 5.4303 -0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3007 6.1809 -0.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5341 6.5008 0.8315 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3623 7.2285 0.7062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0667 7.6546 -0.5439 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6926 7.3402 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8603 6.6124 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7152 3.3981 -0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3241 2.5166 0.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1606 2.9522 1.6471 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2159 0.9998 0.8591 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6568 0.5810 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9855 -0.8168 0.7008 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2946 -1.6742 -0.4019 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0128 -1.3792 1.8535 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 0.4552 -0.1873 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9765 0.7111 -1.5471 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2069 -0.2226 -0.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2684 0.3090 -0.8868 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7426 -1.4839 0.4982 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8663 -2.1799 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7217 -3.4005 1.9127 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2363 -4.6397 1.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0152 -5.4847 0.6077 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -6.7064 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3361 -7.1435 0.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -6.3524 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9799 -5.1107 1.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1218 -2.2366 -0.5947 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0033 -2.2496 -1.8045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9169 -2.9006 -0.6549 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9781 -4.1035 -1.1007 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4751 -5.2103 -1.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -6.0385 -2.6326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1516 -6.0404 -0.8216 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -3.4260 -2.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7254 -4.3120 -2.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9004 -4.4809 0.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1752 -4.3975 0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3826 -2.9219 -0.5102 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6179 -2.7866 1.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8134 -1.6834 -0.9765 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2024 -2.6304 1.7159 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1829 0.8140 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0352 -0.6092 -0.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5128 -0.5811 -0.5698 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5475 0.5648 2.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9749 2.2524 0.4728 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 1.4833 0.9692 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0632 1.1361 -1.7369 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3014 -1.0029 -1.3734 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3128 0.0566 -2.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7056 -0.0672 -0.6322 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1304 2.2973 -2.4861 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1187 3.2692 -1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 2.4199 -0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 -1.7475 2.3685 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2433 1.5314 1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3906 0.5797 -0.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9459 1.9148 -1.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8409 2.1555 0.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3469 3.7251 0.9723 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6826 4.2520 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5195 2.3724 -0.7476 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5292 4.1037 -1.1872 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 3.9441 1.7012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9337 3.6854 -1.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 5.7236 -0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0818 5.6237 0.8429 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7985 6.2067 1.8404 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2329 7.4742 1.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0004 8.2333 -0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3551 7.6729 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4257 6.3882 -2.3977 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3461 3.8593 -0.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8683 0.8566 1.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0401 0.9767 -0.3408 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3265 1.1118 1.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3291 -1.8190 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6063 -2.1394 -1.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6039 1.5955 -1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 0.8979 -2.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5557 -0.1507 -1.9106 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -1.1659 1.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7125 -2.3610 0.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3228 -1.4086 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0994 -3.1560 2.8436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7374 -3.6321 2.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9936 -5.1450 0.3655 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2382 -7.3405 -0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0338 -8.1171 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5378 -6.7120 1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2677 -4.5826 2.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7265 -1.3917 -2.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0541 -2.3238 -1.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -3.1697 -2.3946 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 3 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 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 14 19 1 0 19 20 2 0 19 21 1 0 9 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 29 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 2 0 40 45 1 0 45 46 1 0 45 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 2 0 49 58 1 0 58 59 1 0 58 60 1 0 60 61 2 0 60 5 1 0 36 31 1 0 57 52 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 1 4 68 1 0 4 69 1 0 4 70 1 0 5 71 1 6 6 72 1 0 9 73 1 1 10 74 1 0 13 75 1 0 14 76 1 1 15 77 1 0 15 78 1 0 16 79 1 6 17 80 1 0 17 81 1 0 17 82 1 0 18 83 1 0 18 84 1 0 18 85 1 0 21 86 1 0 22 87 1 0 22 88 1 0 23 89 1 0 23 90 1 0 24 91 1 0 24 92 1 0 25 93 1 0 25 94 1 0 26 95 1 0 29 96 1 6 30 97 1 0 30 98 1 0 32 99 1 0 33100 1 0 34101 1 0 35102 1 0 36103 1 0 37104 1 0 40105 1 1 41106 1 0 41107 1 0 43108 1 0 43109 1 0 46110 1 0 46111 1 0 46112 1 0 49113 1 1 50114 1 0 50115 1 0 51116 1 0 51117 1 0 53118 1 0 54119 1 0 55120 1 0 56121 1 0 57122 1 0 59123 1 0 59124 1 0 59125 1 0 M END