RDKit 3D 42 42 0 0 0 0 0 0 0 0999 V2000 11.9555 1.5420 0.9796 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5754 1.1375 0.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4485 0.7870 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1342 0.3525 0.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0207 -0.0363 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7148 -0.5096 -0.5355 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -0.9273 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2764 -1.4487 -1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3775 -1.1272 0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9911 -1.6104 -0.1561 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0589 -0.8192 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4184 -1.3010 -0.3758 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4374 -0.4583 -0.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8128 -0.8942 -0.5817 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9991 -2.1442 -0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8881 0.0085 -0.5835 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6708 1.4077 -0.3842 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0044 2.0045 0.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6052 1.0748 1.1137 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0438 -0.2235 0.4598 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2288 -0.4853 -0.7895 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4052 0.8411 1.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5726 1.4162 0.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9332 2.5657 1.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8493 -0.9985 -2.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3017 -2.5605 -1.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3372 -0.0101 0.1231 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7448 -1.5378 0.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8011 -2.6797 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0859 0.2371 -0.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6508 -2.3470 -0.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2656 0.5973 -0.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9075 1.6439 0.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4501 1.9111 -1.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8671 2.9889 0.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6437 2.0603 -0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7989 0.8097 1.8334 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4505 1.5950 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1197 -0.1747 0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9096 -1.0981 1.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2224 -1.5962 -0.9614 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6795 0.0068 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 3 0 3 4 1 0 4 5 3 0 5 6 1 0 6 7 3 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 16 1 0 1 22 1 0 1 23 1 0 1 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 17 33 1 0 17 34 1 0 18 35 1 0 18 36 1 0 19 37 1 0 19 38 1 0 20 39 1 0 20 40 1 0 21 41 1 0 21 42 1 0 M END