RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 -3.5792 2.3401 1.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7576 1.7507 0.7613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5169 0.2490 0.9702 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5029 -0.4176 -0.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6973 -1.9444 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -2.2224 -0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9596 -1.0481 -1.7969 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.8125 -0.1290 -1.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0633 0.0115 0.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1625 0.8298 1.2102 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9522 -0.5313 -0.4381 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3915 -0.2358 -0.1947 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6881 1.2835 -0.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1941 1.4607 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7113 0.1336 -1.4615 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7765 -0.6039 -0.8189 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8106 0.6321 -2.8169 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2193 -0.8314 -1.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8233 -0.8589 1.1451 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0558 2.2372 2.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5499 1.8408 1.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 3.4055 1.7241 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3028 1.9163 -0.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8125 2.2969 0.6876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1679 0.0815 1.9986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4927 -0.2492 0.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8691 -2.3137 1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8312 -2.4941 -0.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8406 -2.2551 -0.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7712 -3.1283 -1.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8526 -0.5500 -1.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -1.3415 -2.7847 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0036 -0.4152 -2.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1183 0.8925 -1.7138 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7863 -1.4190 -0.8927 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 1.7263 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.8216 0.6379 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4569 2.4200 -0.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7078 1.3500 0.5644 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4728 -1.8845 -1.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6974 -0.7258 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.7681 1.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5749 -1.9263 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3145 -0.3861 1.9915 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 3 1 1 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 4 9 1 0 9 10 2 0 9 11 1 0 12 11 1 6 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 12 19 1 0 8 4 1 0 18 12 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 11 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 14 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 19 44 1 0 M CHG 1 7 1 M END