RDKit 3D 107111 0 0 0 0 0 0 0 0999 V2000 5.8053 0.5094 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7655 -0.2789 -1.7724 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4532 0.0528 -1.2432 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3282 1.4798 -0.6873 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7272 1.4411 0.6234 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7268 2.2903 1.0038 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8349 1.5398 1.4207 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9179 2.3355 1.7117 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1174 1.4750 1.9736 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8828 0.6204 3.0564 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 3.1069 2.9689 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3274 2.1963 3.9831 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3576 3.9499 2.7046 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9529 4.4811 3.9376 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2308 3.1490 2.1442 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2405 4.0115 1.6265 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9124 1.8149 -0.6254 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9576 0.7996 -0.3821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1019 -0.2798 -1.1351 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2717 -1.4590 -1.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -2.4515 -1.8315 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8126 -1.5853 -0.2325 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6187 -2.7401 -0.1786 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5217 -3.2545 1.2529 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5713 -2.4142 1.9984 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8573 -1.1921 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7787 -1.2969 3.4512 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5388 -2.4287 3.9077 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0631 -0.2132 3.8929 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9659 -0.3100 4.8624 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1532 -0.0198 1.9107 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1499 0.0766 0.9556 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2533 -0.8264 1.1458 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1745 -0.5720 0.1406 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4317 -0.2033 0.6079 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2809 -1.2749 0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6004 -0.8992 0.1984 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4271 -2.1580 0.0561 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2557 -2.9542 1.2029 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9072 0.0482 -0.9024 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4115 -0.6838 -1.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6703 0.7566 -1.3401 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9578 0.0672 -2.3138 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 1.0489 -0.1061 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6607 1.7825 0.7671 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6713 -2.2193 1.0251 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0929 -2.4463 -0.3596 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7360 -3.6983 -0.9165 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -0.1788 -2.0849 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2609 -1.1261 -3.1934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2012 -0.7809 -4.3118 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1219 -1.7730 -5.3322 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3799 -2.2025 -5.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7561 0.3877 -4.9839 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.3145 -5.1137 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7596 1.5316 -1.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7365 0.1544 -2.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9599 -1.3341 -2.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3117 -0.6475 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8418 2.1507 -1.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0912 2.9610 0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 3.0011 0.8485 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9605 2.1274 2.2405 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3550 0.8232 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2585 -0.2791 2.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4524 3.7158 3.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2587 2.6087 4.8801 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6116 4.7645 1.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7748 4.8099 4.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7717 2.4915 2.9127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 4.5854 2.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1747 0.8602 0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -3.5529 -0.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7843 -4.3163 1.3546 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5114 -3.0938 1.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8838 -2.9404 2.9266 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6528 0.0844 5.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2702 -1.3693 5.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8782 0.2564 4.5606 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5947 0.8546 2.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6532 -0.7290 2.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3877 -0.1371 1.7069 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9037 -0.4544 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0288 -2.7984 -0.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4947 -1.9633 -0.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 -2.3608 1.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6543 0.8254 -0.6225 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2908 -0.3041 -2.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9623 1.7324 -1.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 0.7398 -2.7378 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0221 1.7068 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 2.7014 0.4257 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4859 -2.9502 1.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2824 -1.6194 -1.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -4.4110 -0.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0347 -4.2325 -1.6082 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7152 -3.5068 -1.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0639 0.8780 -2.5702 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2628 -1.2743 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6305 -2.1244 -2.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2344 -0.6282 -4.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3153 -2.9809 -6.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9976 -1.3826 -6.0921 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8278 -2.6346 -4.7423 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4012 2.2068 -5.6392 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1936 1.6532 -4.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6443 0.9583 -5.7084 H 0 0 0 0 0 0 0 0 0 0 0 0 53 52 1 0 52 51 1 0 51 50 1 0 50 49 1 0 49 3 1 0 3 2 1 0 2 1 2 3 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 8 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 4 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 46 1 0 46 47 1 0 47 48 1 0 46 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 37 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 33 32 1 0 32 31 1 0 31 26 2 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 51 54 1 0 54 55 1 0 19 49 1 0 47 23 1 0 44 35 1 0 15 6 1 0 26 25 1 0 53102 1 0 53103 1 0 53104 1 0 51101 1 1 50 99 1 0 50100 1 0 49 98 1 6 3 59 1 1 2 58 1 0 1 56 1 0 1 57 1 0 4 60 1 6 6 61 1 6 8 62 1 6 9 63 1 0 9 64 1 0 10 65 1 0 11 66 1 1 12 67 1 0 13 68 1 6 14 69 1 0 15 70 1 1 16 71 1 0 18 72 1 0 23 73 1 6 24 74 1 0 24 75 1 0 25 76 1 1 46 93 1 1 47 94 1 6 48 95 1 0 48 96 1 0 48 97 1 0 33 81 1 1 35 82 1 1 37 83 1 1 38 84 1 0 38 85 1 0 39 86 1 0 40 87 1 1 41 88 1 0 42 89 1 6 43 90 1 0 44 91 1 6 45 92 1 0 31 80 1 0 30 77 1 0 30 78 1 0 30 79 1 0 55105 1 0 55106 1 0 55107 1 0 M END