RDKit 3D 56 59 0 0 0 0 0 0 0 0999 V2000 8.2521 1.5824 0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 1.4383 0.5014 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1524 0.3471 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7582 0.1702 -0.0766 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 1.1033 0.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5523 2.2390 1.1975 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9556 2.3672 1.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7923 3.3744 1.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5545 0.8658 0.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7074 1.0261 1.7305 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0306 1.4234 2.8471 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2599 0.6819 1.4058 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1508 -0.9946 0.7007 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -1.0740 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0773 -2.2183 -0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5357 -2.3081 -0.6344 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3713 -1.2909 0.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6619 -1.4644 0.4783 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4069 -0.3082 1.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9105 1.0384 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4218 1.1876 0.8573 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6363 -0.0473 0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3414 0.0521 0.5028 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 -2.4646 0.3277 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.7417 -2.2354 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8394 -2.4897 -2.9349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4395 -2.2389 -4.2667 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1244 -1.8473 -4.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -1.8402 -2.9179 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2901 -3.3915 -0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6503 -4.3471 -0.6062 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1819 -1.0455 -0.7573 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6870 0.9939 1.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5484 2.6293 0.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6721 1.2389 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7731 -0.3844 -0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4214 3.2251 1.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3043 4.3267 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7935 3.4890 1.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.2352 2.9127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2033 0.1756 -0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1099 1.4310 0.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3287 0.7320 2.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -3.3071 -0.3244 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2791 -0.3643 2.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4885 -0.3527 0.9417 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 1.1183 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4506 1.8546 1.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0371 2.0498 0.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2297 1.3721 1.9222 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8113 -2.8001 -2.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0415 -2.3225 -5.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3949 -1.5496 -4.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -1.6936 -1.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5414 -0.7416 -1.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 -1.6468 -0.0463 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 2 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 18 24 1 0 16 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 15 30 1 0 30 31 3 0 4 32 1 0 7 2 1 0 23 14 1 0 22 17 1 0 29 25 1 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 12 42 1 0 12 43 1 0 16 44 1 1 19 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 26 51 1 0 27 52 1 0 28 53 1 0 32 54 1 0 32 55 1 0 32 56 1 0 M CHG 1 24 -1 M END