RDKit 3D 112113 0 0 0 0 0 0 0 0999 V2000 -9.2439 3.7010 3.3796 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3598 2.7120 3.5949 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8289 2.0737 2.3312 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7092 1.2907 1.6126 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1763 0.2134 2.4666 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0559 -0.5877 1.9983 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0737 -1.4195 0.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1994 -0.7674 -0.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1287 -1.6810 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0274 -2.4212 -2.2025 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1515 -3.4105 -1.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1677 -3.3084 -0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0342 -2.3324 -0.7630 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3033 -2.5725 -1.9029 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2906 -0.9203 -0.4576 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8934 -0.1643 -1.4856 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4286 -0.1701 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0166 0.1262 0.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4714 0.9191 -0.8133 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4655 0.2781 -2.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5643 -0.9201 -2.2691 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7681 -1.4154 -3.6007 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9112 -0.6227 -2.1447 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4272 0.2604 -3.2411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3315 1.2167 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 0.8019 -1.0593 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5618 0.3109 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -0.8601 -1.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3906 -1.4229 -0.7561 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6757 -0.7172 -0.9288 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8076 0.5776 -0.2509 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2048 1.1788 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2975 0.2966 0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2430 0.0054 1.5730 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0373 -0.6030 1.8968 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7179 1.0123 2.5318 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1285 1.3942 2.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1434 0.9716 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4118 1.7046 2.1238 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4195 0.7310 2.6967 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9881 2.6086 3.1133 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6473 2.4646 3.3847 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9814 3.1159 4.2295 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2832 -0.1586 -0.9377 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4107 4.2905 2.4672 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2448 3.2196 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2692 4.4236 4.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1178 1.9659 4.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2415 3.2795 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1596 2.8310 1.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6425 1.3731 2.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3130 0.7928 0.7869 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9928 2.0219 1.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0375 -0.4967 2.7084 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8724 0.6257 3.4907 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1281 0.0938 1.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -1.2846 2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2943 -2.1924 0.8209 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0292 -2.0931 0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1914 -0.2093 -0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4698 0.1061 -0.6472 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -1.0451 -2.5815 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0326 -2.4262 -1.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5286 -3.0309 -3.1313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4357 -1.6914 -2.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8286 -4.3168 -1.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5686 -3.9542 -2.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4886 -3.2466 0.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6703 -4.3849 -0.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2799 -2.7353 0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8043 -2.1686 -2.6787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2893 -1.0306 0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7937 0.7920 -1.2264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5622 -0.6389 1.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9558 0.8432 0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7177 0.6326 1.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3504 -0.7954 0.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0645 1.8986 -0.9186 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 1.2889 -0.4935 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4757 -0.0666 -2.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2333 1.0290 -2.9681 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8698 -1.6948 -1.5878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0345 -2.0394 -3.7362 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4059 -1.6274 -2.3206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9944 -0.2933 -4.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 0.8398 -3.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9346 2.2752 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3449 1.2524 -2.9025 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9343 1.6640 -0.4132 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1647 1.1991 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2679 0.0041 0.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0973 -0.7648 -2.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3443 -1.7179 -1.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2462 -1.7069 0.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4786 -2.5035 -1.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9039 -0.5799 -2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4859 -1.4526 -0.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4059 0.5830 0.7348 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1999 1.3215 -0.8787 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3679 1.2682 -1.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1797 2.1785 0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2441 0.8545 -0.1348 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3363 -0.6341 -0.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9924 -0.8857 1.7009 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0995 -1.2261 2.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1256 1.9534 2.5531 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5471 0.5819 3.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0544 0.1823 1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7986 2.2288 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 0.7888 2.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6397 1.0412 3.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9641 -0.2802 2.6558 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 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 15 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 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 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 2 0 26 44 1 0 44 23 1 0 42 37 1 0 1 45 1 0 1 46 1 0 1 47 1 0 2 48 1 0 2 49 1 0 3 50 1 0 3 51 1 0 4 52 1 0 4 53 1 0 5 54 1 0 5 55 1 0 6 56 1 0 6 57 1 0 7 58 1 0 7 59 1 0 8 60 1 0 8 61 1 0 9 62 1 0 9 63 1 0 10 64 1 0 10 65 1 0 11 66 1 0 11 67 1 0 12 68 1 0 12 69 1 0 13 70 1 1 14 71 1 0 15 72 1 1 16 73 1 0 17 74 1 0 17 75 1 0 18 76 1 0 18 77 1 0 19 78 1 0 19 79 1 0 20 80 1 0 20 81 1 0 21 82 1 1 22 83 1 0 23 84 1 6 24 85 1 0 24 86 1 0 25 87 1 0 25 88 1 0 26 89 1 1 27 90 1 0 27 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 6 35105 1 0 36106 1 0 36107 1 0 38108 1 0 39109 1 6 40110 1 0 40111 1 0 40112 1 0 M END