RDKit 3D 104108 0 0 0 0 0 0 0 0999 V2000 8.9158 1.8175 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8133 0.8501 -0.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7822 1.1987 -2.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7283 -0.5914 -0.4749 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8462 -0.6865 0.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4161 -1.1407 -0.9911 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3314 -0.2918 -0.3456 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4261 -0.8115 0.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5514 -2.3067 0.6528 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3448 -0.0639 1.1333 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4329 1.4012 0.8021 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4189 1.5502 -0.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2825 0.8262 0.3095 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9124 1.6082 1.5277 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0019 -0.4775 0.6991 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0708 -1.1860 1.5818 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5306 -2.1578 2.4103 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9631 -1.7088 0.6199 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2729 -0.4960 0.0788 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0119 -0.8429 -0.6756 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8271 -1.7488 -1.8153 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8548 -1.6042 0.3675 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -1.7071 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9219 -0.3461 -0.2831 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2573 -0.5214 -0.5269 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0862 -0.0329 0.4561 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8118 -1.0624 1.1037 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4367 -0.4342 2.1840 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6593 -1.3680 3.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4267 -1.8536 3.7788 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7326 0.1460 1.6616 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.0546 1.2320 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5182 0.5394 0.2361 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9839 -0.4264 -0.6655 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1145 0.9057 -0.1096 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8182 2.2190 0.3135 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1459 0.3524 -1.3527 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3837 -0.2584 -2.6809 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6531 1.8006 -1.4664 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 0.4492 -0.9073 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9109 1.4776 -1.6669 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3167 1.7708 -0.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1189 0.5039 -0.6021 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6635 0.1413 -1.9362 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9372 1.5479 1.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9758 2.8473 -0.3157 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7814 1.5056 -2.6898 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4786 2.0307 -2.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1047 0.3475 -2.9736 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5995 -1.0829 -0.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7136 -1.1032 1.1066 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4181 -0.8791 -2.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2751 -2.2036 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3535 0.7432 -0.5873 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6075 -2.4842 1.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9281 -2.6797 1.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4238 -2.8578 -0.2855 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5363 -0.2427 2.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3683 1.8021 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0969 2.0512 1.6501 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 0.9712 -1.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2282 2.5968 -0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4853 1.2990 2.4248 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8542 1.5572 1.8355 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1349 2.6798 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1372 -1.0891 -0.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5458 -0.4301 2.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -2.1329 3.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5062 -2.2962 -0.1271 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2882 -2.2659 1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1464 0.0197 1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0319 -1.3858 -2.8125 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2439 -2.1116 -1.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4093 -2.7161 -1.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7374 -1.1980 1.3706 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4695 -2.6666 0.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3891 -2.3716 -0.9439 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8441 -2.1848 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8312 0.1787 0.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4913 0.4338 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8264 0.4435 2.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3428 -2.1762 3.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0691 -0.7517 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9901 -1.1228 4.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4957 -0.6669 1.7443 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7668 1.7811 2.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1509 1.4511 0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0452 0.0459 -1.5442 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0538 0.9478 -1.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8544 2.2454 0.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7146 0.1902 -3.4584 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4175 0.0747 -3.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4235 -1.3532 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3103 2.4263 -0.6449 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3084 2.1551 -2.4818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7775 1.8019 -1.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7983 0.9080 0.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6798 1.2230 -2.6921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5035 2.4405 -1.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0965 2.0889 0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9155 2.5992 -1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3481 -0.6943 -1.9999 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2223 1.0563 -2.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9117 -0.0090 -2.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 2 1 2 3 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 1 13 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 6 20 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 1 0 28 29 1 0 29 30 1 0 28 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 24 37 1 0 37 38 1 0 37 39 1 0 37 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 6 15 10 1 0 43 19 1 0 43 13 1 0 40 20 1 0 35 26 1 0 3 47 1 0 3 48 1 0 3 49 1 0 1 45 1 0 1 46 1 0 4 50 1 6 5 51 1 0 6 52 1 0 6 53 1 0 7 54 1 0 9 55 1 0 9 56 1 0 9 57 1 0 10 58 1 1 11 59 1 0 11 60 1 0 12 61 1 0 12 62 1 0 14 63 1 0 14 64 1 0 14 65 1 0 15 66 1 6 16 67 1 1 17 68 1 0 18 69 1 0 18 70 1 0 19 71 1 1 21 72 1 0 21 73 1 0 21 74 1 0 22 75 1 0 22 76 1 0 23 77 1 0 23 78 1 0 24 79 1 1 26 80 1 1 28 81 1 1 29 82 1 0 29 83 1 0 30 84 1 0 31 85 1 6 32 86 1 0 33 87 1 6 34 88 1 0 35 89 1 6 36 90 1 0 38 91 1 0 38 92 1 0 38 93 1 0 39 94 1 0 39 95 1 0 39 96 1 0 40 97 1 1 41 98 1 0 41 99 1 0 42100 1 0 42101 1 0 44102 1 0 44103 1 0 44104 1 0 M END