RDKit 3D 103103 0 0 0 0 0 0 0 0999 V2000 5.7953 -2.8723 3.4412 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8436 -2.9310 1.9171 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7525 -2.0052 1.4209 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -1.9674 -0.0915 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6549 -1.0896 -0.4484 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 0.1181 -1.0835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0692 0.5015 -2.0357 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9111 1.0288 -0.6945 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4827 1.7378 -1.9075 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5043 2.0398 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5009 3.0385 -0.1518 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1608 4.2828 -0.7274 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6422 3.4591 1.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 3.6862 0.5382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6106 4.9150 1.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5247 5.3529 0.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6119 4.2806 0.3598 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6845 4.6831 -0.6093 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4508 3.5138 -1.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5432 2.3552 -0.2176 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9472 1.7596 -0.2033 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8684 2.8717 0.3079 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 1.3767 -1.5915 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8402 0.2281 -1.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1564 -0.9105 -1.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2726 -1.6540 -0.4823 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6826 -2.8249 0.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2727 -2.6330 1.6853 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6557 -3.7133 2.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8105 -1.3919 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0765 -2.6572 -0.9446 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2863 -3.2242 0.1980 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4531 -4.6271 0.2234 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7964 -2.9944 0.0286 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1130 -3.8292 0.9327 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3195 -3.3702 -1.3514 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0317 -4.0289 -1.3156 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0643 -5.0680 -0.4078 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1493 -3.0586 -0.9942 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3893 -3.7769 -1.0626 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -3.3243 -0.6724 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6673 -4.1100 -0.7867 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4016 -3.6654 3.8945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1475 -1.8398 3.7132 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7331 -2.9296 3.7631 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8465 -2.5644 1.6048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7212 -3.9688 1.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8138 -2.3118 1.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0622 -0.9727 1.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6956 -1.5818 -0.4257 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7608 0.4498 -0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1025 0.9890 -2.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7037 2.0686 -2.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1428 2.5572 -1.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 2.6131 0.6069 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1877 1.5282 1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8387 2.6329 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 4.2723 -1.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1964 4.4007 -0.3662 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 5.1775 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6638 2.6482 1.7965 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0342 4.4056 1.4672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2554 3.8576 -0.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6532 2.7672 0.7399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3871 5.6892 1.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 4.6699 2.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 5.4286 -0.7764 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9859 6.3062 0.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0209 4.3243 1.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2335 3.2858 0.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3456 5.4185 -0.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2194 5.2217 -1.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4754 3.8790 -1.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9213 3.1753 -2.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3516 2.6762 0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8363 1.5623 -0.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0089 0.9593 0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3137 3.8154 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7005 3.0458 -0.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3006 2.5986 1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1202 2.1851 -2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0884 0.1314 -3.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2152 -1.2224 -1.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3945 -3.7865 -0.0559 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7972 -2.8053 0.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1862 -4.6299 2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7701 -3.7977 2.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3437 -3.5125 3.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5979 -0.5637 -1.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4327 -1.0610 0.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -3.4155 -1.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4022 -2.4885 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5836 -2.8670 1.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2706 -4.9018 -0.2657 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5088 -1.9572 0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6886 -4.5911 1.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2839 -2.4810 -2.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0151 -4.1113 -1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1923 -4.4707 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9824 -5.4413 -0.3722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9483 -2.6309 0.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0815 -2.2393 -1.7386 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6958 -5.0989 -0.6213 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 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 28 29 1 0 26 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 41 4 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 0 2 47 1 0 3 48 1 0 3 49 1 0 4 50 1 6 8 51 1 1 9 52 1 0 9 53 1 0 9 54 1 0 10 55 1 0 10 56 1 0 11 57 1 6 12 58 1 0 12 59 1 0 12 60 1 0 13 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 15 65 1 0 15 66 1 0 16 67 1 0 16 68 1 0 17 69 1 0 17 70 1 0 18 71 1 0 18 72 1 0 19 73 1 0 19 74 1 0 20 75 1 0 20 76 1 0 21 77 1 1 22 78 1 0 22 79 1 0 22 80 1 0 23 81 1 0 24 82 1 0 25 83 1 0 27 84 1 0 27 85 1 0 29 86 1 0 29 87 1 0 29 88 1 0 30 89 1 0 30 90 1 0 31 91 1 0 31 92 1 0 32 93 1 1 33 94 1 0 34 95 1 1 35 96 1 0 36 97 1 0 36 98 1 0 37 99 1 6 38100 1 0 39101 1 0 39102 1 0 42103 1 0 M END