RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 -4.4422 -0.2588 2.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5619 0.4305 1.6222 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2713 -0.1751 0.3366 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5671 0.7526 -0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9869 1.8875 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1122 2.1868 1.1264 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8637 1.5387 2.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9455 1.9668 3.2234 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2993 2.7953 -0.7239 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.5824 0.2824 -2.0505 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2141 -0.7492 -2.3258 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8637 1.0313 -3.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 0.0602 -3.8402 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5813 -0.1789 -2.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7587 0.6987 -1.4756 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7612 0.1921 -0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -1.0359 -1.2369 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -1.2141 -2.4105 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0601 -2.1388 -0.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7063 -2.1370 0.5169 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4979 -3.3090 0.7152 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4517 -4.1538 -0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4221 -3.5512 -1.5960 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3045 0.9219 0.4283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6038 1.3896 0.5334 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 2.0882 1.7569 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6891 2.1419 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3718 1.3249 1.8040 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5016 -1.3915 0.5998 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7764 0.4076 3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3234 -0.6205 2.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9038 -1.0958 3.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2435 -0.4486 -0.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 3.0277 1.4131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 2.0357 -2.9297 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6026 1.1722 -3.9624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2356 1.5566 -1.3001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6074 -1.3557 1.2598 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0704 -3.5161 1.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9418 -5.1114 -0.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3558 1.2331 -0.2307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7729 2.5444 2.0408 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5589 2.6153 3.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -1.7440 -0.3099 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1374 -2.0966 0.9608 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 2 0 5 6 1 0 6 7 1 0 7 8 2 0 5 9 1 0 4 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 2 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 16 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 3 29 1 0 7 2 1 0 18 14 2 0 23 19 1 0 28 24 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 6 6 34 1 0 12 35 1 0 12 36 1 0 15 37 1 0 20 38 1 0 21 39 1 0 22 40 1 0 25 41 1 0 26 42 1 0 27 43 1 0 29 44 1 0 29 45 1 0 M CHG 1 9 -1 M END