RDKit 3D 126126 0 0 0 0 0 0 0 0999 V2000 -13.0818 -0.2555 1.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0320 0.8308 1.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6238 2.1891 1.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6190 2.4801 0.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0319 2.4500 -1.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9743 3.4407 -1.3491 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7326 3.2514 -1.6985 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2160 1.9066 -2.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6704 1.9220 -3.4656 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.5582 2.8012 -3.7331 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4893 1.3137 -3.9516 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.3509 0.7063 -3.2037 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7579 -0.4025 -2.3287 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4768 -0.4178 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7566 0.5610 -0.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4851 0.2124 0.3581 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7932 -0.8801 0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0859 -2.0932 -0.4513 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1543 -2.5340 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -2.9081 -1.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7929 -1.9544 -0.7167 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8922 -0.7091 -0.7363 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6311 -2.4548 -0.1768 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4929 -1.9096 0.3538 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2931 -1.1178 -0.6575 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6771 -2.1983 -1.7306 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2911 -3.2325 -1.0474 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8676 -4.4626 -2.0706 P 0 0 2 0 0 5 0 0 0 0 0 0 3.6611 -3.9008 -3.2094 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5742 -5.3669 -2.6768 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8046 -5.5477 -1.1121 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1256 -5.5806 0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7367 -6.4601 1.1399 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8357 -7.7967 0.7822 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0654 -5.9561 1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4762 -6.6639 2.7907 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5155 -0.6909 -0.1678 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0731 0.5377 -0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4863 1.4599 -0.8898 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4834 0.8046 0.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3889 -0.0423 -0.5151 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8386 -0.0813 -0.3248 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3999 -0.4847 0.9653 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2931 0.3610 2.1615 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0886 1.6740 2.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 2.4352 3.2516 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6836 3.6987 3.4551 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1457 3.6843 3.4865 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0229 3.2796 2.3993 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9948 4.0637 1.1473 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7412 4.1613 0.3669 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0536 3.4561 0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1011 4.1977 -1.1157 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7339 -0.9742 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1906 -0.7873 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0151 0.1740 1.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2913 0.7466 2.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4175 0.7223 0.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7592 2.9207 1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0437 2.4033 2.2497 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0791 3.4860 0.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4813 1.7773 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7771 1.4050 -1.4378 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8733 2.6947 -1.9766 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2540 4.4906 -1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0144 4.0854 -1.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9391 1.0875 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3947 1.7031 -1.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4815 2.1500 -4.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4411 1.1422 -5.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 0.2304 -3.9493 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7402 1.4187 -2.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3160 -1.2627 -2.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9094 -1.2732 -0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4855 0.8528 0.5876 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6087 1.5655 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0483 1.0332 1.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8549 -0.9009 0.9027 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9622 -2.9590 0.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1218 -2.2992 -0.7373 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1503 -1.6850 -2.2899 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6554 -3.4274 -2.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2717 -3.4185 -2.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7784 -3.7767 -0.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1973 -1.2589 1.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1149 -2.7413 0.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7294 -0.3342 -1.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -1.7636 -2.4323 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7912 -2.4845 -2.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9173 -6.1898 -3.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0928 -4.5399 0.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0895 -5.9554 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0263 -6.4440 2.0281 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1865 -8.3234 1.5568 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8565 -6.1288 0.8949 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0385 -4.8864 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -6.2565 3.6313 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7152 1.8611 0.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3971 0.5231 1.3485 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9552 -1.1117 -0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 0.2113 -1.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2268 -0.8554 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2384 0.9196 -0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 -0.8362 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9197 -1.4895 1.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2938 0.5409 2.5303 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8013 -0.2243 3.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 2.1999 1.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1258 1.3457 1.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8572 2.6384 3.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2528 1.7369 4.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3815 3.9823 4.5711 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2031 4.5916 2.9542 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4468 3.1497 4.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4860 4.7613 3.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1327 2.1715 2.2157 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1091 3.4758 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4421 5.0833 1.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5815 3.2196 -0.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8101 4.3275 0.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9193 4.9581 -0.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7308 2.4221 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0345 3.4890 0.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9616 3.8059 -1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1983 4.1101 -1.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3272 5.2873 -0.9853 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 2 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 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 28 27 1 1 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 25 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 11 9 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 6 11 70 1 6 12 71 1 0 12 72 1 0 13 73 1 0 14 74 1 0 15 75 1 0 15 76 1 0 16 77 1 0 17 78 1 0 18 79 1 0 18 80 1 0 19 81 1 0 19 82 1 0 20 83 1 0 20 84 1 0 24 85 1 0 24 86 1 0 25 87 1 6 26 88 1 0 26 89 1 0 30 90 1 0 32 91 1 0 32 92 1 0 33 93 1 1 34 94 1 0 35 95 1 0 35 96 1 0 36 97 1 0 40 98 1 0 40 99 1 0 41100 1 0 41101 1 0 42102 1 0 42103 1 0 43104 1 0 43105 1 0 44106 1 0 44107 1 0 45108 1 0 45109 1 0 46110 1 0 46111 1 0 47112 1 0 47113 1 0 48114 1 0 48115 1 0 49116 1 0 49117 1 0 50118 1 1 51119 1 0 51120 1 0 51121 1 0 52122 1 0 52123 1 0 53124 1 0 53125 1 0 53126 1 0 M END