RDKit 3D 53 55 0 0 0 0 0 0 0 0999 V2000 -6.6785 -3.1513 -0.2956 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6457 -1.7435 -0.3453 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4029 -1.0896 -0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4561 -1.8405 0.0442 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3636 0.3270 -0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3096 1.0623 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5532 2.4714 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8077 3.0127 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9601 0.6429 0.3057 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6422 -0.3735 1.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9982 0.8333 -0.8339 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6344 0.4239 -0.5162 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2768 -0.8502 -0.6386 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1111 -1.3004 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4519 -2.6316 -0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1172 -2.5734 0.0027 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2745 -0.8800 0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4946 -0.0739 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4465 1.2930 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0901 1.6668 0.9209 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7061 0.0834 0.9576 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1168 -0.3891 1.2029 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6981 -1.2069 0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0366 0.6967 1.7081 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6454 -0.3861 2.4645 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6365 -0.6553 0.7016 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0525 -0.4532 -0.0379 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0959 2.1363 -1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5287 2.1871 -2.6214 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 -3.4806 -1.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6516 -3.5689 -0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9832 -3.5621 0.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 0.8463 -0.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2233 2.6572 -1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5473 2.6739 0.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7885 4.1107 -0.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 1.6487 0.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7948 0.0416 1.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4648 -0.4999 2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1952 -1.3207 0.9955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 0.1856 -1.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1431 1.1242 -0.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -1.5519 -0.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7815 -3.4804 -0.5945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5653 1.9461 0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7920 -1.2144 0.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4236 -0.6455 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2645 -2.2174 -0.0062 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0718 0.7497 1.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 1.6804 1.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8225 1.6556 -3.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5559 3.2361 -2.9619 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 1.7473 -2.6233 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 6 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 6 22 24 1 0 24 25 1 0 21 26 2 0 17 27 2 0 11 28 1 0 28 29 1 0 27 14 1 0 26 18 1 0 25 22 1 0 1 30 1 0 1 31 1 0 1 32 1 0 5 33 1 0 8 34 1 0 8 35 1 0 8 36 1 0 9 37 1 1 10 38 1 0 10 39 1 0 10 40 1 0 11 41 1 6 12 42 1 0 13 43 1 0 15 44 1 0 19 45 1 0 23 46 1 0 23 47 1 0 23 48 1 0 24 49 1 0 24 50 1 0 29 51 1 0 29 52 1 0 29 53 1 0 M END