RDKit 3D 29 31 0 0 0 0 0 0 0 0999 V2000 6.5403 -0.5455 -1.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1232 -0.3221 -1.0413 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -0.3586 0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -0.0854 -0.2366 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1428 0.1000 -1.6295 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3762 -0.0435 -2.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8592 0.0022 0.6883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 0.2766 0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2786 0.2897 1.2169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2324 0.0348 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9199 -0.2414 2.3856 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7059 0.5788 0.8762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6327 -0.9695 0.6537 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2087 -0.3277 0.2614 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4992 0.9514 0.3459 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8098 1.2061 -0.0088 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4593 0.1144 -0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5086 -1.3138 -0.2585 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7466 0.0826 -0.7411 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9869 0.3565 -1.6212 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9836 -0.7566 -0.2193 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6839 -1.3987 -1.8631 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8722 -0.5701 1.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3233 0.3326 -2.2975 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2938 -0.0076 3.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7496 1.1674 -0.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1608 1.1701 1.6787 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0399 -0.6967 -1.3185 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1325 0.9738 -1.0363 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 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 9 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 6 2 1 0 11 7 1 0 18 14 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 5 24 1 0 10 25 1 0 12 26 1 0 12 27 1 0 19 28 1 0 19 29 1 0 M END