RDKit 3D 54 57 0 0 0 0 0 0 0 0999 V2000 5.5319 -0.7500 -2.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -1.3684 -2.6389 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0838 -0.8560 -2.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9879 0.3951 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9475 1.0602 -1.3713 N 0 0 0 0 0 4 0 0 0 0 0 0 2.3240 2.2181 -0.5273 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8201 2.0625 -0.4576 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2275 0.9898 -1.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4972 0.3859 -1.3999 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5051 2.0707 0.7595 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2783 2.1720 0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1643 1.7139 1.9186 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4242 1.4690 3.1425 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7146 0.1207 3.8132 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0311 -1.1203 2.9634 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3561 -1.3040 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1665 -1.2061 1.5849 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6936 -1.0198 0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0208 -0.7266 -0.7924 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0456 -1.1845 0.0792 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7837 -0.9999 -1.1216 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0442 -1.6525 -0.8207 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1148 -0.8067 -1.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4467 -1.1985 -1.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4458 -0.2615 -1.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1134 1.0612 -1.7282 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7762 1.4605 -1.7674 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7967 0.5200 -1.4822 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0521 0.7607 -1.4578 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4825 -1.2453 -2.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4469 -2.2927 -3.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1901 -1.3333 -2.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9953 0.6850 -1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0361 3.1367 -1.0462 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 2.7453 0.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4061 0.8312 -1.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1712 1.7551 1.9942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3451 1.5633 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6889 2.2759 3.8362 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5635 0.2609 4.4976 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8619 -0.1121 4.4682 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8284 -2.0106 3.5756 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1165 -1.1335 2.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -0.5998 0.9035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6395 -2.2912 1.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5247 -0.3564 2.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5999 -2.1185 2.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6239 -1.2169 0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2719 -1.4758 -1.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1408 -2.5753 -1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7203 -2.2109 -0.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4926 -0.5569 -1.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9044 1.7820 -1.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5182 2.4884 -2.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 6 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 9 1 2 0 8 4 1 0 29 21 1 0 28 23 1 0 1 30 1 0 2 31 1 0 3 32 1 0 5 33 1 0 6 34 1 6 7 35 1 0 9 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 14 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 16 44 1 0 16 45 1 0 17 46 1 0 17 47 1 0 20 48 1 0 21 49 1 6 22 50 1 0 24 51 1 0 25 52 1 0 26 53 1 0 27 54 1 0 M CHG 1 5 1 M END