RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 6.4269 1.1008 0.8857 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1372 0.6123 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 1.2002 1.3681 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7712 0.6241 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5764 -0.5596 0.5676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2848 -1.2404 0.3860 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1925 -1.6463 -0.9484 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9846 -0.4332 -1.6307 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0965 0.2774 -0.8062 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0824 -0.3768 0.5434 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1322 -1.3137 0.5899 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3346 -1.5848 -0.7625 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4116 -0.2639 -1.2683 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5811 0.3594 -0.6491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 1.6180 -0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7906 2.1133 0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9471 1.3643 0.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1167 1.8639 1.0645 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9145 0.0954 -0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0689 -0.7110 -0.0222 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7562 -0.3939 -0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6964 -1.1521 0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9502 -0.5891 0.1296 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0432 -1.2283 -0.4489 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7207 1.9339 1.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 2.1313 1.9049 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9252 1.1045 1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.1068 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -0.6902 -2.6374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8978 0.1701 -1.7009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 1.3558 -0.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.3203 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9888 -0.8090 1.0658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8453 -2.2538 1.0858 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4343 -0.2619 -2.3593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 2.2058 -0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8235 3.0991 0.8736 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9405 1.2826 1.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0297 -1.6397 -0.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7745 -1.4023 -1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5937 -2.0812 -0.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9106 -2.0946 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 22 1 0 22 23 2 0 23 24 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 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 2 0 23 2 1 0 10 6 1 0 21 14 1 0 13 9 1 0 1 25 1 0 3 26 1 0 4 27 1 0 22 41 1 0 24 42 1 0 6 28 1 1 8 29 1 0 8 30 1 0 9 31 1 1 10 32 1 1 11 33 1 0 11 34 1 0 13 35 1 6 15 36 1 0 16 37 1 0 18 38 1 0 20 39 1 0 21 40 1 0 M END