RDKit 3D 54 58 0 0 0 0 0 0 0 0999 V2000 7.9201 0.1214 -0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5624 -0.5143 -0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4215 -1.8998 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1631 -2.5363 -0.4361 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0339 -1.7024 -0.2727 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1436 -0.3136 -0.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4185 0.2810 -0.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9504 0.3728 -0.0337 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9419 -0.4657 0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 -2.1096 -0.1719 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6093 -0.0445 0.1384 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 1.4046 0.1384 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5688 1.9901 1.4929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2908 1.5794 2.7838 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 2.6095 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2554 3.5957 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1364 3.2340 1.5204 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.9506 0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2615 -2.0136 1.0832 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7894 -0.6082 0.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7954 -0.6296 1.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1176 -0.3338 0.7018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4715 -0.0271 -0.6257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4356 -0.0428 -1.5795 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1104 -0.3376 -1.2292 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8229 0.2803 -0.9934 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 0.8532 -2.1928 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4937 1.2772 -3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6902 0.9131 -2.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1441 0.6223 -0.8643 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9240 0.0705 -0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9955 -0.4619 0.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1033 -4.0326 -0.5763 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 1.0675 0.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6843 -0.5289 -0.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1746 0.3149 -1.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3138 -2.5140 -0.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4939 1.3630 -0.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9963 1.8842 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6764 1.6287 -0.1563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1627 0.6416 3.0739 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7459 2.6097 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7158 4.5593 3.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5595 -0.8734 2.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8506 -0.3438 1.5038 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6244 0.1434 -2.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3455 -0.3636 -2.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0209 1.9036 -2.5966 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0454 0.1554 -2.9765 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9586 -0.1070 -0.8486 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4561 1.5341 -0.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -4.3189 -1.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7863 -4.5070 0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1036 -4.4296 -0.3866 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 8 9 2 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 11 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 23 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 4 33 1 0 7 2 1 0 10 5 1 0 17 13 1 0 25 20 1 0 31 26 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 7 38 1 0 12 39 1 0 12 40 1 0 14 41 1 0 15 42 1 0 16 43 1 0 21 44 1 0 22 45 1 0 24 46 1 0 25 47 1 0 29 48 1 0 29 49 1 0 30 50 1 0 30 51 1 0 33 52 1 0 33 53 1 0 33 54 1 0 M END