RDKit 3D 86 88 0 0 0 0 0 0 0 0999 V2000 -0.3599 -0.6237 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8794 -1.7045 2.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1328 -2.0600 1.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1656 -1.4600 0.8682 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7925 -1.8758 -0.1353 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7274 -0.4638 1.6307 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9722 0.1388 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -0.9068 1.4575 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -0.3097 1.1932 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5315 0.3188 -0.1565 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -0.6591 -1.2793 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4123 0.0115 -2.6123 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 0.6027 -2.9049 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8158 -0.4166 -2.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6392 -1.5205 -3.7321 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8714 -0.3847 -2.1988 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2415 0.6295 -1.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5156 1.9298 -1.6421 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4850 2.5051 -2.9142 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8397 2.6485 -0.5587 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7985 1.8599 0.5737 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0206 2.0252 1.9143 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8101 0.6404 2.8825 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2851 -0.6214 1.3036 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4182 0.5808 0.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1949 -2.3485 2.4632 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3257 -1.3690 2.4421 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3407 -0.6849 1.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5565 0.2249 1.0967 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3877 1.0105 2.2686 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7748 -0.6143 1.3558 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8673 -1.7646 0.5993 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0118 0.2072 1.3673 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4953 0.6788 0.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9811 0.4431 -1.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4745 0.9210 -2.4093 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4067 1.7985 -3.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8068 1.5819 -2.4038 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.8537 0.7208 -1.7745 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2020 1.9328 -3.7119 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5753 -1.1335 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5029 -2.0439 2.6941 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0781 -0.4171 3.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2524 0.3328 2.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5639 -0.9857 3.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5374 -2.8436 0.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9039 0.5898 0.3653 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2069 0.9475 2.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0929 -1.2735 2.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8623 -1.8044 0.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1614 -1.1028 1.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5657 0.4808 1.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7823 1.1544 -0.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5525 0.7207 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9991 -1.5016 -1.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2727 -1.1064 -1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6558 0.8275 -2.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2264 -0.7824 -3.3884 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7233 1.0599 -3.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9401 1.4128 -2.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9621 -2.4403 -3.4994 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3645 2.7489 -3.3518 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3229 2.9978 2.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 -3.0839 1.6522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -2.8462 3.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2331 -0.5665 3.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3622 -1.4015 0.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4503 -0.0388 1.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6162 0.9320 0.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7875 1.7765 2.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8352 -2.0047 0.5424 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 -0.4005 1.8184 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8781 1.0486 2.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3994 1.3188 0.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0854 -0.1934 -1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5682 0.0167 -3.0712 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5068 2.8524 -2.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5861 1.8306 -4.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3995 1.3975 -2.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7944 2.5582 -1.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5565 0.3660 -2.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4808 -0.2215 -1.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4795 1.2496 -1.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9004 2.6382 -3.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4799 -1.6077 3.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2148 -0.2910 3.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 39 38 1 0 38 40 1 0 38 36 1 0 36 37 1 0 36 35 1 0 35 34 2 0 34 33 1 0 33 31 1 0 31 32 1 6 31 41 1 0 41 42 1 0 42 27 1 0 27 26 1 0 26 2 1 0 2 1 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 17 25 2 0 25 24 1 0 24 23 1 0 23 22 1 0 22 21 2 0 21 20 1 0 20 18 2 0 18 19 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 18 17 1 0 21 25 1 0 39 81 1 0 39 82 1 0 39 83 1 0 38 80 1 1 40 84 1 0 36 76 1 6 37 77 1 0 37 78 1 0 37 79 1 0 35 75 1 0 34 74 1 0 33 72 1 0 33 73 1 0 32 71 1 0 41 85 1 0 41 86 1 0 27 66 1 1 26 64 1 0 26 65 1 0 1 43 1 0 1 44 1 0 1 45 1 0 3 46 1 0 7 47 1 0 7 48 1 0 8 49 1 0 8 50 1 0 9 51 1 0 9 52 1 0 10 53 1 0 10 54 1 0 11 55 1 0 11 56 1 0 12 57 1 0 12 58 1 0 13 59 1 0 13 60 1 0 15 61 1 0 22 63 1 0 19 62 1 0 28 67 1 0 28 68 1 0 29 69 1 6 30 70 1 0 M END