RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 4.0911 0.6276 0.5156 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 0.0121 -0.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3538 -1.0202 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4721 -1.4297 -1.5301 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1494 -1.4880 -1.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0819 -0.8910 -0.8319 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4539 -1.9007 0.0663 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8136 -2.2224 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2313 -3.2659 1.1144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9267 -1.6654 -0.6634 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1346 -2.3258 -0.4364 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1403 -0.2073 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5999 0.4971 0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1045 1.8276 0.2940 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2673 2.8484 0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1247 2.2396 1.3354 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 2.2365 -0.1354 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2861 1.5202 -0.5336 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4149 2.3608 -0.3422 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6371 0.2138 0.0237 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1218 0.4382 0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8245 1.3889 1.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3971 -0.4906 -1.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1845 -2.4077 0.7277 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4229 -3.5888 1.7856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6267 -4.1336 0.5854 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.7745 1.7762 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -1.9037 -1.7528 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7248 -2.2936 -1.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8456 0.3272 -1.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2534 -0.0340 -0.6086 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9274 -0.2041 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4313 0.5976 1.3767 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9136 2.6344 -0.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8092 2.7891 1.2763 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8545 3.8769 0.2517 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2102 3.3423 -0.3922 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 1.3904 -1.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2538 3.0003 0.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4437 0.0783 1.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 9 8 1 0 8 7 2 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 20 1 0 20 18 1 0 18 19 1 0 18 17 1 0 17 16 1 0 16 14 1 0 14 15 1 6 14 13 1 0 13 12 1 0 12 10 1 0 10 11 1 0 10 8 1 0 20 6 1 0 14 17 1 0 9 25 1 0 9 26 1 0 9 27 1 0 7 24 1 0 6 23 1 6 1 21 1 0 1 22 1 0 20 40 1 1 18 38 1 6 19 39 1 0 17 37 1 6 15 34 1 0 15 35 1 0 15 36 1 0 13 32 1 0 13 33 1 0 12 30 1 0 12 31 1 0 10 28 1 6 11 29 1 0 M END