RDKit 3D 149151 0 0 0 0 0 0 0 0999 V2000 18.0607 3.2047 -2.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6670 2.8481 -1.9253 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8477 1.6353 -1.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5319 1.1282 -0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9150 2.1508 0.4141 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6246 1.8910 1.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4136 0.7631 1.9515 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5067 -0.6327 1.4565 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5098 -0.8702 0.3485 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0779 -0.6921 0.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 -1.6272 1.8231 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7426 -3.0578 1.4843 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0478 -3.6144 0.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5927 -3.6197 0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 -2.3832 0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2929 -2.7157 0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5387 -1.3802 0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0655 -1.6059 -0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6138 -2.2425 -1.3601 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -1.3821 -2.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -0.0480 -2.4125 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7328 -0.2646 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -1.3693 -2.7708 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4991 0.8417 -1.7575 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0577 2.3362 -1.0071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7178 2.2068 0.3016 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9594 1.6862 1.3778 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3977 0.4066 1.4646 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4839 -0.4638 0.5865 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3704 0.0285 2.7082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9104 -1.3658 2.5346 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8453 -1.4387 1.4237 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0379 -0.6876 1.4586 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2774 0.0350 2.4602 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9941 -0.7609 0.3191 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4155 -1.4361 -0.7199 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3933 0.6224 -0.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2069 1.4428 -0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1034 1.2739 1.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3845 0.6497 -1.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5539 -0.0316 -0.9037 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6218 0.0336 -2.1887 P 0 0 1 0 0 5 0 0 0 0 0 0 -7.6454 1.4592 -2.7444 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2296 -1.0235 -3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2044 -0.3573 -1.6636 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0798 -0.9534 -0.0809 P 0 0 2 0 0 5 0 0 0 0 0 0 -8.0928 -0.0712 0.6925 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4186 -2.5120 -0.0902 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5379 -0.8866 0.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6472 -0.9483 -0.1199 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8848 -0.8863 0.6907 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.0791 0.2236 1.4569 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.4026 0.5070 1.6098 C 0 0 1 0 0 0 0 0 0 0 0 0 -14.7081 1.7488 0.9245 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9078 2.5719 0.2332 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6125 3.6187 -0.2359 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.8993 3.4613 0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0523 4.1962 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0040 5.4018 -0.7475 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.1807 3.7270 0.5438 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.2278 2.5838 1.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1056 1.8666 1.4213 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.9506 2.3023 0.8832 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1466 -0.6591 1.0197 C 0 0 2 0 0 0 0 0 0 0 0 0 -15.1658 -1.7080 1.9398 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.1713 -1.0875 -0.0920 C 0 0 2 0 0 0 0 0 0 0 0 0 -14.3671 -2.3812 -0.4985 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.5794 -2.4363 -2.1722 P 0 0 0 0 0 5 0 0 0 0 0 0 -15.7876 -3.3202 -2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.8110 -0.8972 -2.8316 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2379 -3.1220 -2.9436 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0222 3.3792 -3.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4549 4.1000 -1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7904 2.3787 -2.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0401 2.6021 -2.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3242 3.7339 -1.3872 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5819 1.8247 -0.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2049 0.8015 -1.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8813 0.7128 -1.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9207 0.3093 0.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8442 3.1037 -0.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6663 2.4620 1.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3571 2.8648 1.6109 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7894 1.9099 0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0931 0.9188 2.8537 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3545 0.9111 2.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4940 -0.8950 1.1141 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3136 -1.3696 2.3069 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8122 -0.2367 -0.5072 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6513 -1.9323 -0.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9353 0.3436 1.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4212 -0.7643 -0.1731 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3398 -1.3752 2.7005 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6617 -1.3769 2.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4732 -3.7183 2.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8629 -3.2736 1.4172 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3541 -4.7242 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5376 -3.2777 -0.6677 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3561 -4.2790 -0.7086 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1158 -4.2635 1.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0309 -1.8640 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 -1.6332 0.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1272 -3.1820 -0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9311 -3.3073 0.8429 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8779 -0.7077 -0.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7043 -0.8431 0.9923 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7853 -2.3303 0.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4762 -0.6913 0.1384 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1555 -3.2096 -1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 -2.4710 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9771 -1.2643 -2.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4449 -1.8876 -3.4486 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 0.5677 -1.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3602 0.5262 -3.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8293 2.8384 -1.7001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2281 3.1267 -0.9582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1426 3.2220 0.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 1.5603 0.1407 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8149 2.3751 2.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3562 0.0097 3.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1301 0.7819 2.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0722 -2.0742 2.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4033 -1.6463 3.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6297 -2.0430 0.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9246 -1.2952 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -1.3702 -1.5523 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3668 0.8239 -0.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4809 2.1714 -1.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 2.0290 0.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4688 0.4596 1.7792 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 1.9215 1.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9697 1.8550 0.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9266 0.2777 -2.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6291 1.7221 -1.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4458 -0.6220 -4.3459 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6339 -2.9754 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5593 -0.1112 -0.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5581 -1.9092 -0.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8558 -1.7638 1.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5985 0.6046 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8405 2.4240 0.0693 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3806 6.2658 -0.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6093 5.4426 -1.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1866 2.2665 1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1296 -0.4022 0.6169 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8558 -2.3568 1.5866 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1805 -0.3286 -0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5554 -0.4077 -2.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5183 -3.3575 -3.8614 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 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 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 37 39 1 0 37 40 1 0 40 41 1 0 42 41 1 1 42 44 1 0 42 43 2 0 42 45 1 0 46 45 1 6 46 48 1 0 46 47 2 0 46 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 64 1 0 64 65 1 0 64 66 1 0 66 67 1 0 67 68 1 0 68 70 1 0 68 71 1 0 68 69 2 0 53 54 1 0 54 55 1 0 55 56 2 0 56 57 1 0 57 63 2 0 63 62 1 0 62 61 2 0 61 60 1 0 60 58 2 0 58 59 1 0 66 51 1 0 63 54 1 0 58 57 1 0 1 72 1 0 1 73 1 0 1 74 1 0 2 75 1 0 2 76 1 0 3 77 1 0 3 78 1 0 4 79 1 0 4 80 1 0 5 81 1 0 5 82 1 0 6 83 1 0 6 84 1 0 7 85 1 0 7 86 1 0 8 87 1 0 8 88 1 0 9 89 1 0 9 90 1 0 10 91 1 0 10 92 1 0 11 93 1 0 11 94 1 0 12 95 1 0 12 96 1 0 13 97 1 0 13 98 1 0 14 99 1 0 14100 1 0 15101 1 0 15102 1 0 16103 1 0 16104 1 0 17105 1 0 17106 1 0 18107 1 0 18108 1 0 19109 1 0 19110 1 0 20111 1 0 20112 1 0 21113 1 0 21114 1 0 25115 1 0 25116 1 0 26117 1 0 26118 1 0 27119 1 0 30120 1 0 30121 1 0 31122 1 0 31123 1 0 32124 1 0 35125 1 1 36126 1 0 38127 1 0 38128 1 0 38129 1 0 39130 1 0 39131 1 0 39132 1 0 40133 1 0 40134 1 0 44135 1 0 48136 1 0 50137 1 0 50138 1 0 51139 1 1 53140 1 1 64145 1 6 65146 1 0 66147 1 6 70148 1 0 71149 1 0 55141 1 0 61144 1 0 59142 1 0 59143 1 0 M END