RDKit 3D 122128 0 0 0 0 0 0 0 0999 V2000 11.0600 -1.1405 2.2886 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6961 -0.4837 0.9641 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5044 -0.9139 0.4578 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7284 0.0407 -0.1831 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7384 -0.6577 -0.8602 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4414 -0.3754 -0.4449 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7524 0.3319 -1.5859 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2158 -0.2972 -2.8675 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 -0.4612 -3.0991 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2963 -0.7020 -3.8109 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4037 0.3330 -1.5925 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7536 -0.2932 -0.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3991 -0.2594 -0.8688 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6014 0.4076 0.0555 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0296 1.6814 -0.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4467 1.7048 -0.6663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2048 1.2361 0.5795 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9140 2.3851 1.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6482 0.0064 1.1488 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6939 -1.1282 1.2188 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8152 -0.5056 2.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5863 0.5263 1.1631 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9841 1.6067 2.2092 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6801 1.2393 0.2112 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8918 1.0018 -1.2401 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3379 0.7759 -1.5035 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2261 0.3124 -0.6879 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6605 0.1342 -1.1240 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4984 1.3313 -0.9245 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7943 1.2509 -0.2537 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9150 1.4061 -1.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9584 2.4358 0.6768 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0867 -0.0056 0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5365 -1.2365 -0.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1788 -1.2069 -0.6877 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4086 -2.0141 -1.9724 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1815 -1.5508 -3.0976 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8858 -3.2980 -1.8276 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2182 -2.0751 0.0574 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9542 -3.3161 -0.6089 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8746 -1.5976 0.4598 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8157 -0.0969 0.6966 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8690 0.1213 1.7534 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5862 -0.5755 0.5579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2928 -1.3811 1.6538 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3025 -1.6029 -0.5219 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2944 -1.6776 -0.3990 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2494 -2.4560 -1.5399 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7187 -1.5700 0.0738 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4458 -2.7337 -0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6075 0.8391 -1.1018 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2612 -0.0126 -1.9754 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6573 1.5958 -0.3329 C 0 0 2 0 0 0 0 0 0 0 0 0 11.8946 1.5756 -1.0235 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8687 0.9960 1.0501 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0737 1.6270 1.9735 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6957 -0.5496 3.1528 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6995 -2.1787 2.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1660 -1.1865 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4918 -0.8475 0.2441 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3274 0.7238 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4537 0.3944 0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1544 1.4071 -1.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2842 -1.6636 -4.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9855 0.2530 0.3823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2555 0.7089 0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4299 2.5832 0.0118 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4626 1.7771 -1.5466 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7005 1.2074 -1.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7396 2.7923 -0.7938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1581 2.0930 2.5966 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 3.3211 1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2147 2.5304 1.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 0.1506 2.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2821 -1.9397 1.8117 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9235 -1.3634 0.1829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4675 -1.1929 2.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3042 0.0505 2.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3639 2.5435 2.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0012 2.0096 1.9954 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7922 1.3079 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9387 2.3522 0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2867 0.1465 -1.6377 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5888 1.8738 -1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7265 1.0319 -2.5193 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6247 0.0706 -2.2752 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8338 2.0939 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6847 1.9046 -1.9049 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8925 1.3861 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9058 0.5962 -2.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8283 2.4121 -1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1383 3.1684 0.5163 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9529 2.8662 0.5458 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9395 2.0504 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7587 0.1016 1.5547 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1974 -0.0901 0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3476 -1.6868 -0.7187 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4985 -1.9938 0.7775 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5325 -3.6754 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8009 -2.5050 0.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5339 -3.0582 -1.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1891 -1.8134 -0.3932 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5494 -2.2198 1.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5307 -0.7762 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4175 0.2277 2.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5561 0.9371 1.6009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5724 -1.5420 2.5097 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5801 -2.3924 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1932 -0.8582 1.9832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0387 -2.5785 -0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2694 -1.8104 -1.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4218 -1.2795 -1.2622 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 -2.2589 0.3905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8285 -3.2615 -1.3558 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6767 -1.5112 1.2058 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9759 -3.0407 0.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0157 1.6327 -1.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1236 0.2433 -2.9245 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4212 2.6670 -0.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6344 1.4076 -1.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 1.2219 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5839 1.7508 2.8224 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 49 1 0 49 50 1 0 49 47 1 0 47 48 1 0 47 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 1 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 1 22 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 33 34 1 0 34 35 1 0 35 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 1 35 36 1 6 36 38 1 0 36 37 2 0 19 44 1 0 44 45 1 0 44 46 1 0 12 11 1 0 11 7 1 0 7 8 1 0 8 10 1 0 8 9 2 0 4 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 55 2 1 0 7 6 1 0 44 14 1 0 24 17 1 0 42 27 1 0 42 22 1 0 35 28 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 6 4 61 1 1 6 62 1 1 49115 1 1 50116 1 0 47113 1 1 48114 1 0 12 65 1 1 14 66 1 1 15 67 1 0 15 68 1 0 16 69 1 0 16 70 1 0 18 71 1 0 18 72 1 0 18 73 1 0 19 74 1 1 20 75 1 0 20 76 1 0 21 77 1 0 21 78 1 0 23 79 1 0 23 80 1 0 23 81 1 0 24 82 1 6 25 83 1 0 25 84 1 0 26 85 1 0 28 86 1 6 29 87 1 0 29 88 1 0 31 89 1 0 31 90 1 0 31 91 1 0 32 92 1 0 32 93 1 0 32 94 1 0 33 95 1 0 33 96 1 0 34 97 1 0 34 98 1 0 39100 1 1 40101 1 0 41102 1 0 41103 1 0 43104 1 0 43105 1 0 43106 1 0 38 99 1 0 45107 1 0 45108 1 0 45109 1 0 46110 1 0 46111 1 0 46112 1 0 7 63 1 6 10 64 1 0 51117 1 6 52118 1 0 53119 1 1 54120 1 0 55121 1 1 56122 1 0 M END