RDKit 3D 67 70 0 0 0 0 0 0 0 0999 V2000 -4.6380 -1.1357 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1811 -0.4149 -1.5665 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4396 -0.7688 -0.2840 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.3384 -0.4245 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8572 -1.0429 2.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9979 -0.2133 -0.1398 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9852 -1.0329 -0.9967 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6135 -0.8363 -0.5815 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1658 -1.8403 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2867 -2.9434 0.2547 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5676 -1.4343 0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6744 -2.2239 0.5415 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7502 -1.3604 0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2724 -0.1382 0.1949 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9485 -0.1581 -0.0816 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9913 1.1201 0.1083 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4963 2.1467 1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2038 3.4466 0.7914 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2414 3.4863 -0.9926 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1226 4.2778 -1.4586 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 3.7279 -1.4144 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8599 1.7713 -1.2649 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1435 -1.7158 0.9444 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3165 -3.2475 0.9123 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1263 -3.9902 1.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7871 -3.6750 0.8537 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8796 1.2975 -0.2884 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9657 2.1136 0.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8419 3.5012 0.7565 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6302 4.0966 -0.4819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5422 3.3067 -1.6252 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6657 1.9194 -1.5318 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3908 -1.1216 -3.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3919 -2.1806 -2.5724 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7593 -0.6345 -3.1907 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1949 0.6718 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2161 -0.7485 -1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3511 -1.7923 -0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4276 0.6642 0.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3284 -0.8411 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6074 -2.1017 2.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6509 -0.9685 2.9459 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9863 -0.5204 2.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -0.4546 0.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0107 -0.7689 -2.0565 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2287 -2.1008 -0.9202 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0978 0.0135 -0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0501 0.9198 0.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 2.2835 1.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7087 1.8354 2.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2372 3.4442 1.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6787 4.3253 1.1747 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8442 1.7238 -1.6673 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5537 1.3487 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3358 -1.3479 1.9594 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8735 -1.2520 0.2728 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4224 -3.5806 -0.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2448 -3.5216 1.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3038 -5.0728 1.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0596 -3.7046 2.6128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 -4.0005 1.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7278 -4.2398 -0.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1054 1.6887 1.8482 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8986 4.1164 1.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 5.1763 -0.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3618 3.7786 -2.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5741 1.3482 -2.4533 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 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 2 0 19 22 1 0 13 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 6 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 15 11 2 0 26 12 1 0 22 16 1 0 32 27 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 3 38 1 0 4 39 1 0 4 40 1 0 5 41 1 0 5 42 1 0 5 43 1 0 6 44 1 1 7 45 1 0 7 46 1 0 8 47 1 0 16 48 1 1 17 49 1 0 17 50 1 0 18 51 1 0 18 52 1 0 22 53 1 0 22 54 1 0 23 55 1 0 23 56 1 0 24 57 1 0 24 58 1 0 25 59 1 0 25 60 1 0 26 61 1 0 26 62 1 0 28 63 1 0 29 64 1 0 30 65 1 0 31 66 1 0 32 67 1 0 M CHG 1 3 1 M END