RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 1.0449 2.1948 -2.8703 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5432 1.0486 -1.9926 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0258 1.2654 -1.6167 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7099 2.1146 -2.1815 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4876 0.3724 -0.6614 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8133 0.2037 -0.2136 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 0.7854 -0.8318 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2126 0.5498 -0.3434 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4081 -0.2605 0.7787 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3039 -0.8561 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0155 -0.6257 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7961 -0.4882 1.2568 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7603 -0.3707 0.5124 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9605 -0.8014 2.5778 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5297 0.8351 -0.4582 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1074 0.5505 -1.1639 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1374 -0.6915 -1.9475 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3277 -1.3453 -1.6767 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9491 -0.6502 -0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2416 0.4368 -0.2338 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0634 0.6745 1.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7709 -0.0425 2.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3166 -0.2958 2.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3212 -1.0720 -0.4024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3257 -0.3266 0.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5089 1.0381 0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7201 1.4271 0.8906 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8445 0.5068 0.9665 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7676 -0.7845 0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4668 -1.2672 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1677 -2.4327 -0.3159 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.7527 -2.4715 -0.7205 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9968 3.1375 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0608 1.9887 -3.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7186 2.3549 -3.7204 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5081 0.1132 -2.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7699 -0.1268 -0.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8251 1.4167 -1.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0657 1.0030 -0.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4318 -1.5243 2.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1761 -1.1083 1.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9211 -0.8059 2.8997 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2520 -0.5784 3.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3528 1.3903 -1.8196 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3597 -1.2755 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8639 1.7318 1.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4283 -0.8813 2.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0422 0.5432 3.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 0.1129 2.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0288 -1.2586 1.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6859 1.7433 0.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8943 2.4584 1.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7842 0.9176 1.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6256 -1.4440 0.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8441 -3.1926 -0.3718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7123 -2.7124 -1.7859 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2434 -3.2241 -0.1132 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 9 12 1 0 12 13 2 0 12 14 1 0 2 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 19 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 11 6 1 0 20 16 1 0 23 21 1 0 32 24 1 0 30 25 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 6 5 37 1 0 7 38 1 0 8 39 1 0 10 40 1 0 11 41 1 0 14 42 1 0 14 43 1 0 16 44 1 6 17 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 23 49 1 0 23 50 1 0 26 51 1 0 27 52 1 0 28 53 1 0 29 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 M CHG 1 31 1 M END