RDKit 3D 42 44 0 0 0 0 0 0 0 0999 V2000 1.9843 1.5583 1.5608 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0726 1.5863 0.0699 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1476 2.4936 -0.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2808 0.1408 -0.3883 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2008 -0.5184 0.3911 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8988 -0.3817 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0181 0.6088 -0.1605 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7345 1.8343 -0.5948 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8817 1.7638 -1.9664 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3732 0.4276 0.2768 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4816 0.6963 1.7473 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2295 1.3551 -0.3623 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.9329 -0.1344 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2090 -1.0439 -1.6019 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2325 -1.1739 -0.5416 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9406 -2.0232 0.3549 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3973 -3.3698 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.1017 1.7477 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4276 -1.7597 -0.1611 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1913 -2.6835 -0.5354 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4342 2.4211 1.9868 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0334 1.5314 1.9498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5351 0.5903 1.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9124 2.5989 0.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7851 3.5215 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5869 2.0631 -1.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5789 0.2175 -1.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7338 -1.3329 0.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2505 2.7586 -0.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8998 2.6429 -2.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7668 0.1471 2.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 1.7878 1.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5301 0.6125 2.1182 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6527 2.0644 -0.7798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9541 -1.9434 -2.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1622 -0.1156 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7611 -2.1067 -0.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9044 -0.2718 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1474 -3.5505 -1.2087 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7785 -4.1299 0.4235 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4338 -3.5768 0.1237 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7046 -2.4056 2.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 10 12 1 6 10 13 1 0 13 14 1 6 14 15 1 0 13 16 1 0 16 17 1 0 16 18 1 1 16 19 1 0 19 20 2 0 8 2 1 0 15 13 1 0 19 6 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 3 26 1 0 4 27 1 6 5 28 1 0 8 29 1 6 9 30 1 0 11 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 14 35 1 0 14 36 1 0 15 37 1 0 15 38 1 0 17 39 1 0 17 40 1 0 17 41 1 0 18 42 1 0 M END