RDKit 3D 99101 0 0 0 0 0 0 0 0999 V2000 -5.4475 -1.3947 -2.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3105 -0.4982 -1.7512 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1063 -0.4212 -0.2836 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2182 0.7790 -0.2025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5799 1.3980 0.8975 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2691 1.9886 2.0677 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3754 0.5812 1.4557 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8183 -0.6518 1.9222 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4197 0.3903 0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3759 1.1288 0.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 0.8321 -1.0339 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5499 1.5979 -1.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4416 1.3086 -2.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 1.0269 -2.1211 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7211 1.8927 -1.4879 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 3.0197 -1.1222 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1396 1.4452 -1.2591 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9022 2.7411 -0.8935 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7624 0.9350 -2.5045 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2853 0.5342 -0.0901 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9501 1.0601 1.1375 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4615 -0.3273 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5629 -1.5733 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5515 -0.0759 0.6717 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7034 1.0678 1.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8245 1.2651 2.1905 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8497 0.3775 2.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8156 -0.4555 2.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8584 -1.7149 1.3559 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8555 -1.7412 0.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7176 -1.4655 -1.0895 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9096 -1.6310 -1.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7625 -2.0023 -0.7252 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1169 -2.0595 0.3987 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4718 -0.3581 0.2548 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0139 0.8709 -0.2184 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4974 -0.4248 1.7538 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.2605 0.7010 2.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3195 -1.6431 2.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1961 -2.2899 3.1589 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1901 -1.8214 1.0427 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5614 -2.2634 1.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4025 -1.4648 -0.1410 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.8854 -2.6709 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1984 -3.6535 -0.4349 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4552 -2.3416 -2.0471 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2525 -1.3778 -1.3289 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.5299 -0.1027 -2.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7072 -1.4136 -3.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3882 -0.9690 -2.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4321 -2.4197 -1.9714 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5644 -1.3305 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3694 0.5236 -0.9751 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7438 1.5898 -0.8325 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9787 2.3078 0.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5948 2.8038 2.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 1.3145 2.9368 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1806 2.5752 1.7999 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9856 1.1548 2.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1314 -1.3382 1.9249 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5713 -0.4497 -0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1584 1.9661 0.7474 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6875 0.0006 -1.6978 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8203 2.4492 -0.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9981 0.4175 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.1419 -3.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1997 0.0692 -2.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6369 3.1023 0.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6924 3.5435 -1.6356 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9922 2.5479 -0.9202 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8675 1.1682 -2.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3951 1.4825 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6574 -0.1296 -2.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -0.2462 -0.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 0.4170 1.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5838 -1.9212 -1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3028 -1.4352 -1.7024 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0106 -2.3519 -0.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3384 -0.7955 0.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9633 1.8153 1.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8256 2.2092 2.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6108 1.1691 2.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7243 -0.1689 2.6247 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2876 -2.4865 2.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9105 -2.1420 1.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7924 -1.1646 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8324 -2.2239 -0.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5021 1.6471 0.0352 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5455 -0.5835 2.2459 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6999 0.9661 3.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3411 1.6177 1.8181 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2614 0.3718 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7055 -3.1815 0.4666 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9756 -2.3635 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1744 -1.4529 0.5698 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2463 -1.9174 -1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7269 0.3503 -2.6008 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0469 0.5666 -1.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3382 -0.3211 -2.7855 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 4 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 17 15 1 6 17 18 1 0 17 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 3 28 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 3 35 1 0 35 36 1 1 35 37 1 0 37 38 1 0 37 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 1 6 44 45 2 0 44 46 1 0 46 47 1 0 47 48 1 0 34 30 1 0 43 35 1 0 47 43 1 0 1 49 1 0 1 50 1 0 1 51 1 0 3 52 1 1 4 53 1 0 4 54 1 0 5 55 1 6 6 56 1 0 6 57 1 0 6 58 1 0 7 59 1 1 8 60 1 0 9 61 1 0 10 62 1 0 11 63 1 0 12 64 1 0 13 65 1 0 13 66 1 0 14 67 1 0 18 68 1 0 18 69 1 0 18 70 1 0 19 71 1 0 19 72 1 0 19 73 1 0 20 74 1 6 21 75 1 0 23 76 1 0 23 77 1 0 23 78 1 0 24 79 1 0 25 80 1 0 26 81 1 0 27 82 1 0 28 83 1 0 29 84 1 0 29 85 1 0 31 86 1 0 33 87 1 0 36 88 1 0 37 89 1 1 38 90 1 0 38 91 1 0 38 92 1 0 42 93 1 0 42 94 1 0 42 95 1 0 47 96 1 1 48 97 1 0 48 98 1 0 48 99 1 0 M END