RDKit 3D 106109 0 0 0 0 0 0 0 0999 V2000 5.9646 -1.1884 -3.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0384 -1.5923 -2.8206 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5684 -2.7613 -2.8327 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -0.7301 -1.7985 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7453 -1.2341 -0.7487 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6320 -0.2557 -0.8764 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3924 -0.3755 -0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5166 -1.5429 -0.3538 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1507 -1.4847 -1.8533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8673 -2.8130 -0.0667 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1336 -3.4535 1.0992 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -4.8894 1.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0435 -2.7892 2.1488 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8365 -1.1635 0.3163 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9373 -2.0577 -0.1174 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1738 -1.6697 0.6694 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4843 -0.2409 0.2866 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5386 0.2828 0.9952 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8229 1.5538 0.5682 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3258 1.7143 0.3059 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5366 3.1258 -0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0156 1.5616 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4959 1.7113 1.4779 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9581 1.1466 0.1775 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.5346 0.0485 0.5319 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.9569 0.2718 -0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4969 -0.0181 -1.9067 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9231 -1.0533 0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7122 0.8231 -0.6588 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0576 2.0072 -0.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5771 1.9143 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2821 0.6399 0.4534 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0851 1.0689 1.9026 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1158 0.1287 -0.0228 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6107 -1.0441 0.4839 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0642 -1.7369 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9991 -1.6582 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8354 -0.8781 1.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0064 0.3658 1.4575 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8164 1.6160 1.4096 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0411 1.4458 2.3296 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0567 2.7934 2.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3014 1.8781 0.1486 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6329 2.1347 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3903 2.3767 -2.2603 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3902 2.1619 -1.0087 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8888 0.3078 0.6782 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0789 -0.0887 -3.9735 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5209 -1.5019 -4.8835 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9646 -1.6403 -3.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5527 -2.2531 -1.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0879 0.7546 -0.5845 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4181 -0.0575 -1.9889 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7569 0.5337 -0.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5812 -0.1590 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4321 -2.3780 -2.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0638 -1.5024 -2.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4686 -0.5790 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1589 -5.3759 0.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0851 -5.4556 1.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6329 -4.9121 1.0615 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6908 -1.2425 1.4086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7662 -3.1314 0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -1.8454 -1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0209 -2.3192 0.3982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9123 -1.7653 1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7071 -0.2670 -0.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6044 2.2828 1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5752 3.4772 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 3.1856 -1.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8585 3.8580 0.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6315 2.3944 2.2809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7709 0.5802 2.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9807 1.1929 2.3422 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8290 2.7840 1.5689 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3024 1.9226 -0.5476 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1929 0.8330 -2.5501 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0765 -0.9856 -2.2261 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6141 -0.0227 -1.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5043 -1.8365 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3762 -0.9956 1.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8917 -1.4611 0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2803 3.0929 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3577 1.5134 -1.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0785 1.8298 -1.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1692 2.8091 0.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8927 0.6340 2.5296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0336 2.1828 1.9917 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1257 0.6836 2.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8108 -2.7957 1.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2319 -1.2260 2.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8607 -1.7913 2.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0116 -2.7327 0.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -1.5488 -0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7972 -0.5290 0.7552 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0661 -1.4324 2.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 0.2790 2.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8412 0.6266 3.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9399 1.1569 1.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3011 2.4052 2.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6589 3.6936 1.8395 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0409 2.6064 3.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0228 2.8492 1.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7736 2.9132 -3.0118 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3243 2.9079 -2.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6792 1.4012 -2.7097 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 1 10 11 1 0 11 12 1 0 11 13 2 0 8 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 30 1 0 30 31 1 0 31 32 1 0 32 33 1 1 32 34 1 0 19 20 1 0 20 21 1 6 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 1 0 26 29 1 0 5 35 1 0 35 36 1 1 35 37 1 0 37 38 1 0 38 39 1 0 39 47 1 0 39 40 1 0 40 41 1 0 40 42 1 0 40 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 34 14 1 0 29 20 1 0 47 35 1 0 32 17 1 0 1 48 1 0 1 49 1 0 1 50 1 0 5 51 1 6 6 52 1 0 6 53 1 0 7 54 1 0 7 55 1 0 9 56 1 0 9 57 1 0 9 58 1 0 12 59 1 0 12 60 1 0 12 61 1 0 14 62 1 1 15 63 1 0 15 64 1 0 16 65 1 0 16 66 1 0 17 67 1 6 19 68 1 1 30 83 1 0 30 84 1 0 31 85 1 0 31 86 1 0 33 87 1 0 33 88 1 0 33 89 1 0 21 69 1 0 21 70 1 0 21 71 1 0 22 72 1 0 22 73 1 0 23 74 1 0 23 75 1 0 24 76 1 6 27 77 1 0 27 78 1 0 27 79 1 0 28 80 1 0 28 81 1 0 28 82 1 0 36 90 1 0 36 91 1 0 36 92 1 0 37 93 1 0 37 94 1 0 38 95 1 0 38 96 1 0 39 97 1 1 41 98 1 0 41 99 1 0 41100 1 0 42101 1 0 42102 1 0 42103 1 0 45104 1 0 45105 1 0 45106 1 0 M END