RDKit 3D 139142 0 0 0 0 0 0 0 0999 V2000 15.2245 -0.4922 -3.9481 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2567 0.3104 -3.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4667 0.0022 -1.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5291 0.7868 -0.7263 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 0.4955 -1.0333 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1188 1.2650 -0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2867 0.9446 1.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0326 -0.4919 1.5928 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6879 -1.0453 1.3519 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5441 -0.6803 2.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0426 0.6607 2.4016 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5897 1.5128 1.2895 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5988 1.0964 0.4747 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3513 0.8373 1.0944 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4979 1.7959 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1763 1.5777 0.9675 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0148 1.4750 2.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6797 0.3412 0.1994 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3864 0.0083 0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4578 0.2680 -0.4598 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0052 -0.9010 -1.0664 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7793 -1.6835 -0.2787 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8391 -2.3291 -1.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4662 -0.9611 0.8381 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4772 -1.7376 1.4441 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4108 -2.1846 2.7558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4447 -3.0036 3.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3878 -1.8647 3.4153 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8679 0.4284 0.4823 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7929 0.5486 -0.5433 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9455 1.2149 -0.1561 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0380 2.4812 -0.7295 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2406 3.1067 -0.4629 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4218 3.4012 1.0114 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4273 2.3857 -1.0283 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4537 2.4189 -0.0309 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 3.0296 -0.2276 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6601 2.9830 0.9073 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9307 3.5864 -1.3099 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1595 0.9423 -1.3224 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.3691 0.2596 -1.2526 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8200 -0.2771 -2.4241 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.1000 0.2383 -2.7526 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9855 0.0049 -1.6938 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.2416 0.7964 -1.9577 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3562 -1.4585 -1.5999 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.7161 -1.6223 -1.7703 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6056 -2.1285 -0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0382 -2.2278 -1.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1729 -2.4884 0.2526 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4502 -2.2027 -2.5222 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4900 -3.5804 -2.2744 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0141 -1.7810 -2.2030 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1732 -2.4846 -3.0905 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1587 0.3855 -0.3314 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7378 0.0774 0.8964 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8579 -1.2269 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4756 -1.5537 2.6621 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4259 -2.1476 0.6189 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6151 1.1672 0.0446 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9859 2.1484 -0.8722 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5712 -0.8153 0.5167 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0057 -1.4275 1.6724 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9984 -0.5573 0.7259 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6609 -0.9164 -0.4781 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2578 -0.0335 -4.9573 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2263 -0.4046 -3.4712 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9050 -1.5378 -4.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4110 1.3740 -3.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2245 0.0064 -3.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5158 0.3198 -1.3714 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3831 -1.0893 -1.4712 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8061 0.4976 0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7862 1.8581 -0.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8799 0.7996 -2.0907 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8505 -0.5701 -0.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1123 0.8466 -0.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1701 2.3495 -0.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7419 1.6578 1.9405 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3831 1.1163 1.5379 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7641 -1.0880 0.9882 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3403 -0.7013 2.6571 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3923 -0.8919 0.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8225 -2.1867 1.3776 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8049 -1.0870 3.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -1.4005 1.9167 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1404 0.5561 3.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8062 1.2548 3.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1837 2.5066 1.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4106 1.9210 0.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4511 0.9846 2.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5776 2.4289 0.5889 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8078 2.1441 2.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.9553 2.7138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1744 0.5025 2.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7399 0.6928 -0.8708 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0283 0.7831 -1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2204 -2.5463 0.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8445 -1.8926 -0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9088 -3.4164 -1.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6163 -2.1593 -2.2455 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6691 -0.8326 1.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9178 -3.8794 3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -3.4054 2.7534 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8977 -2.4366 4.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2234 0.9104 1.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8187 1.4291 0.9332 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1792 4.0989 -0.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1662 2.7192 1.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4647 3.2478 1.5485 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8254 4.4182 1.1266 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8471 2.9293 -1.9034 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4725 2.0700 1.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5941 3.8397 1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6648 2.8073 0.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8065 0.8819 -2.3685 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1776 -0.0910 -3.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5383 0.3432 -0.7307 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9042 0.8078 -1.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0419 1.8152 -2.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8034 0.2763 -2.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1134 -1.8361 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6342 -2.6522 -0.3811 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1934 -2.8492 -2.1367 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4414 -1.1914 -1.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5870 -1.9622 -3.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3095 -3.6809 -1.3059 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -2.0525 -1.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6204 -3.2433 -3.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8403 -0.6005 -0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5203 -1.1980 2.7214 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4818 -2.6412 2.8392 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8284 -1.1176 3.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2417 1.7262 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7979 3.0614 -0.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4017 -1.6114 -0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4199 -2.1702 1.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3498 -1.2734 1.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0431 -0.9183 -1.2359 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 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 24 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 35 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 48 50 2 0 46 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 40 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 57 59 2 0 29 60 1 0 60 61 1 0 18 62 1 0 62 63 1 0 62 64 1 0 64 65 1 0 64 14 1 0 60 20 1 0 55 31 1 0 53 42 1 0 1 66 1 0 1 67 1 0 1 68 1 0 2 69 1 0 2 70 1 0 3 71 1 0 3 72 1 0 4 73 1 0 4 74 1 0 5 75 1 0 5 76 1 0 6 77 1 0 6 78 1 0 7 79 1 0 7 80 1 0 8 81 1 0 8 82 1 0 9 83 1 0 9 84 1 0 10 85 1 0 10 86 1 0 11 87 1 0 11 88 1 0 12 89 1 0 12 90 1 0 14 91 1 1 16 92 1 6 17 93 1 0 17 94 1 0 17 95 1 0 18 96 1 6 20 97 1 6 22 98 1 1 23 99 1 0 23100 1 0 23101 1 0 24102 1 1 27103 1 0 27104 1 0 27105 1 0 29106 1 1 31107 1 1 33108 1 6 34109 1 0 34110 1 0 34111 1 0 35112 1 6 38113 1 0 38114 1 0 38115 1 0 40116 1 6 42117 1 6 44118 1 1 45119 1 0 45120 1 0 45121 1 0 46122 1 1 49123 1 0 49124 1 0 49125 1 0 51126 1 6 52127 1 0 53128 1 1 54129 1 0 55130 1 6 58131 1 0 58132 1 0 58133 1 0 60134 1 1 61135 1 0 62136 1 6 63137 1 0 64138 1 1 65139 1 0 M END