RDKit 3D 58 61 0 0 0 0 0 0 0 0999 V2000 0.9307 -0.3525 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3208 0.2232 4.7776 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3075 0.0445 3.2889 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1872 0.8943 2.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0275 0.3911 0.9824 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5564 -0.8733 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9633 -1.3546 2.5832 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7786 -1.7225 -0.0757 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3878 -2.9773 -0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0017 -3.4380 0.9036 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2465 -3.7207 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8175 -3.3910 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9061 -4.5677 -3.3616 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3716 -5.5514 -2.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5915 -5.0485 -1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4356 1.2273 -0.2200 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3548 0.3624 -1.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4791 -0.2732 -0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3049 -1.1044 -1.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0464 -1.3032 -2.6423 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9814 -0.6250 -3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1449 0.1974 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0674 -2.3705 -3.6354 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7401 -3.9566 -2.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7043 1.7536 -1.0127 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1969 2.9723 -0.5606 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9416 3.1470 0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3893 4.4242 0.9625 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0601 5.5052 0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3146 5.2844 -1.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9165 4.0437 -1.3107 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.1624 4.6348 2.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0102 -1.4305 5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9095 -0.1855 6.5035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8346 0.1190 5.0233 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 1.2939 5.0105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2134 -0.2424 5.2158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6429 1.8471 2.5783 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3498 -1.4577 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4872 -2.4252 -2.9246 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6649 -4.6879 -4.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6027 -6.6003 -2.6501 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0603 2.0722 0.1078 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7193 -0.1518 0.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1555 -1.5904 -0.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7908 -0.7383 -4.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3224 0.6927 -2.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2732 -4.7493 -3.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6696 -4.1805 -2.8397 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0855 -3.9407 -1.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 1.0582 -0.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2003 2.2954 1.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 6.5135 0.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 6.0719 -1.6921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3725 3.8707 -2.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4705 4.7806 3.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8048 3.7753 2.4461 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8094 5.5150 2.1590 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 4 5 1 0 5 6 2 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 5 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 20 23 1 0 23 24 1 0 16 25 1 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 28 32 1 0 7 3 1 0 15 11 1 0 22 17 1 0 31 26 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 4 38 1 0 8 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 16 43 1 1 18 44 1 0 19 45 1 0 21 46 1 0 22 47 1 0 24 48 1 0 24 49 1 0 24 50 1 0 25 51 1 0 27 52 1 0 29 53 1 0 30 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 32 58 1 0 M CHG 1 31 1 M END