RDKit 3D 82 84 0 0 0 0 0 0 0 0999 V2000 -5.3679 -0.1694 1.1846 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -0.2216 1.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4833 -1.5799 1.9166 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1413 -0.1015 0.0176 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4730 1.1551 -0.6327 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6899 2.3261 -0.5797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5247 3.0121 -1.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0313 2.8125 0.6604 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0909 3.5393 1.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9567 3.7116 0.3541 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4263 3.3671 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2902 4.2158 0.8215 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9716 2.0477 0.0035 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2794 2.2252 -0.7126 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2593 2.9999 -1.9701 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8099 4.3876 -1.9176 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6057 4.6594 -2.1369 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 5.4849 -1.6353 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2125 1.1960 1.1711 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.0820 1.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1941 -0.2564 2.5796 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6223 -1.2560 0.5471 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7919 -2.2080 0.6792 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1028 -1.6120 0.3761 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 -1.7174 -0.8335 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9373 -1.0363 -0.7865 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0475 -0.4808 0.4304 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0231 0.2973 0.9975 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9331 0.7642 2.3026 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.3941 2.9949 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -0.3812 2.4724 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -0.8310 1.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3998 -0.9786 -0.8389 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7418 -1.2102 -1.6079 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1305 -0.1731 -2.2848 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5557 -2.4120 -1.7728 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8680 -3.7159 -1.4628 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8849 -4.8330 -1.7204 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3009 -3.9765 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8414 -2.3847 -1.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6203 -1.2644 -0.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -1.1763 -1.1108 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7835 0.1516 2.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 0.5738 0.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7824 -1.1863 1.0253 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4842 0.5240 2.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -2.0151 1.3859 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -2.3139 1.8113 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1809 -1.5289 2.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0684 -0.1741 0.2886 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 1.1744 -1.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 1.9367 1.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9189 3.8396 0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4887 2.9117 2.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6754 4.4886 1.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1766 4.6926 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2913 1.5698 -0.7227 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9941 2.7259 0.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7463 1.2180 -0.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6283 2.4893 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3098 3.0244 -2.3714 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 6.1870 -1.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8605 1.6659 1.8537 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2774 -1.8720 0.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -3.1104 0.0657 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8376 -2.6140 1.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4371 -2.2611 -1.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6365 -0.9614 -1.5857 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9125 0.5829 0.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6952 1.3805 2.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7063 0.7494 4.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9398 -0.6354 3.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2152 -0.5375 -1.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -2.4876 -2.8909 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6037 -3.8506 -0.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3611 -5.7590 -2.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6521 -4.5331 -2.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4056 -5.1199 -0.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -4.2186 -3.3972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9869 -3.0954 -2.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8793 -4.8340 -1.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2771 -3.3151 -0.9703 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 13 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 22 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 36 40 1 0 40 41 1 0 41 42 2 0 41 4 1 0 32 24 1 0 32 27 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 1 3 47 1 0 3 48 1 0 3 49 1 0 4 50 1 1 5 51 1 0 8 52 1 1 9 53 1 0 9 54 1 0 9 55 1 0 10 56 1 0 13 57 1 6 14 58 1 0 14 59 1 0 15 60 1 0 15 61 1 0 18 62 1 0 19 63 1 0 22 64 1 1 23 65 1 0 23 66 1 0 25 67 1 0 26 68 1 0 28 69 1 0 29 70 1 0 30 71 1 0 31 72 1 0 33 73 1 0 36 74 1 6 37 75 1 1 38 76 1 0 38 77 1 0 38 78 1 0 39 79 1 0 39 80 1 0 39 81 1 0 40 82 1 0 M END