RDKit 3D 105109 0 0 0 0 0 0 0 0999 V2000 -8.5210 0.1179 -4.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5209 -0.8116 -3.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0102 -1.9634 -3.1491 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9830 -0.4440 -1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9462 -1.2713 -0.6865 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.5223 -1.5716 -0.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8291 -0.3199 0.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7549 -0.2681 1.6564 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6863 0.5400 2.1396 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3611 0.2633 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0251 -1.0031 1.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7584 -1.2869 0.6861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7815 -0.3252 0.5949 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4973 -0.5189 0.1137 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.7169 -0.3492 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3042 -1.5329 -1.7101 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6331 -2.7333 -2.3182 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9060 -2.5743 -3.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6531 -3.9110 -1.3916 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3123 -4.9566 -2.0802 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -3.6479 -0.1016 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8507 -4.4092 0.9342 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2802 -2.1676 0.2927 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2698 -1.4102 -0.2749 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0641 -0.7085 0.6509 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3416 -1.1208 0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3793 -0.2895 0.7923 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5684 -0.6642 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6211 0.2178 0.1465 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8424 0.1450 -0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0144 -0.7868 -1.3498 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9262 1.0804 -0.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7798 2.0941 0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7832 3.0147 0.9594 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9849 2.8793 0.2762 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1600 1.8729 -0.6398 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1250 0.9720 -0.8933 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1666 1.1743 0.7181 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0649 1.7696 1.9766 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 1.4746 -0.1466 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7742 2.8479 -0.1666 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 0.7400 0.4131 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5350 1.3313 1.6676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1442 0.9568 1.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3961 1.2288 1.5226 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1363 1.9666 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2861 2.5977 0.8043 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3569 2.3818 -0.0556 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3352 3.4280 0.3613 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7352 3.1384 0.2398 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4698 2.8683 1.5063 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8526 1.3912 1.6738 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7657 0.7608 0.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7516 -0.6746 0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2732 1.1293 -3.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7092 -0.1820 -4.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4986 0.1718 -4.7192 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4155 -2.2336 -0.9614 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0012 -1.9960 -1.1451 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4789 -2.3232 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8414 -0.2882 -0.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3764 0.5923 -0.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9558 -1.1241 2.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6174 0.2886 3.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7206 -1.8352 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5499 -2.2850 0.3695 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -2.5267 -0.2165 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7977 -2.9336 -3.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -3.0972 -4.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1458 -1.5224 -3.3577 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 -3.0239 -2.6354 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6317 -4.3012 -1.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2477 -5.0111 -1.7606 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4357 -3.9519 -0.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -4.4156 1.7311 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2617 -2.0979 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -0.9969 1.6477 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7625 -0.4973 1.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8758 -1.7039 0.1912 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3323 -0.6877 -1.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8355 2.1766 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6488 3.8077 1.6788 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7709 3.5905 0.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1052 1.7969 -1.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2524 0.1718 -1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0525 1.6502 0.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2581 2.7522 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2192 1.1543 -1.1838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2101 3.0364 -0.9775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9052 0.9571 -0.2138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7756 2.2906 1.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3791 1.7437 0.9713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 2.2685 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3593 2.5701 2.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0518 2.0464 2.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0778 4.4364 0.0556 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9612 2.2939 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2739 4.0059 -0.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4852 3.3836 1.4603 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0171 3.2915 2.4229 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8792 1.2916 2.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1424 0.9652 2.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5859 1.0775 -0.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8180 -1.0187 0.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4022 -1.0888 1.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 16 1 0 16 15 1 0 15 14 1 0 14 13 1 0 13 12 2 0 12 11 1 0 11 10 2 0 10 45 1 0 45 44 2 0 10 9 1 0 9 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 15 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 2 0 27 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 23 21 1 0 21 22 1 0 21 19 1 0 19 20 1 0 19 17 1 0 44 13 1 0 8 9 1 0 42 25 1 0 37 32 1 0 18 69 1 0 18 70 1 0 18 71 1 0 17 68 1 6 15 67 1 6 12 66 1 0 11 65 1 0 45 93 1 0 44 92 1 0 9 64 1 1 46 94 1 0 46 95 1 0 49 96 1 0 50 97 1 0 50 98 1 0 51 99 1 0 51100 1 0 52101 1 0 52102 1 0 53103 1 0 54104 1 0 54105 1 0 5 58 1 6 6 59 1 0 6 60 1 0 7 61 1 0 7 62 1 0 8 63 1 0 1 55 1 0 1 56 1 0 1 57 1 0 23 76 1 1 25 77 1 1 27 78 1 1 28 79 1 0 28 80 1 0 33 81 1 0 34 82 1 0 35 83 1 0 36 84 1 0 37 85 1 0 38 86 1 6 39 87 1 0 40 88 1 6 41 89 1 0 42 90 1 6 43 91 1 0 21 74 1 6 22 75 1 0 19 72 1 1 20 73 1 0 M END