RDKit 3D 68 71 0 0 0 0 0 0 0 0999 V2000 -4.5455 1.5971 1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4077 1.3343 0.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2098 0.7673 1.2108 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5064 1.7315 1.9235 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3674 0.1615 0.0765 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3227 0.1841 -1.1289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 1.5179 -0.8755 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9517 2.5638 -0.8927 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5539 2.0709 -1.1368 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2395 3.2303 -0.9617 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1519 0.9702 -0.1428 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1117 0.2930 -0.4826 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4727 0.5567 -1.9291 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1003 -1.1785 -0.1512 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1794 -1.8623 -0.5430 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5223 -1.7157 -1.8607 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2066 -1.2792 0.4101 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4214 -1.9463 0.3804 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0038 -2.6252 1.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 -3.3169 1.3005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3777 -2.6419 2.5316 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -1.9591 -0.5607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1925 -2.5646 -1.9442 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2525 -3.2092 0.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 -1.2814 -0.2879 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4241 -1.5843 -1.3923 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5925 0.1751 -0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2995 0.7921 0.3260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2945 2.1510 0.4109 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1446 2.8546 1.6078 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1415 4.3391 1.6699 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0143 2.1250 2.6142 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 1.4152 2.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3831 2.0136 0.5682 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5576 0.0259 1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9815 1.8591 2.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 -0.6463 -1.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8035 0.2258 -2.0805 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8527 1.6925 -1.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1839 3.2794 -1.7051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9443 3.1831 0.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4848 1.7729 -2.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 3.8432 -0.2997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0394 1.5536 0.8092 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4908 0.1865 -2.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7021 0.2038 -2.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5467 1.6572 -2.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1161 -1.1969 0.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0767 -2.9295 -0.2773 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6612 -2.5649 -2.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 -1.3450 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1408 -2.7475 1.8022 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5587 -3.5621 0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2184 -4.2664 1.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6475 -1.9916 -2.6811 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2297 -2.7913 -2.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6868 -3.5780 -1.9396 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2854 -3.5761 0.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -2.9418 1.3482 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6498 -4.0045 -0.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1431 -1.7785 0.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1194 -0.9042 -1.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3311 0.4338 0.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0259 0.7110 -0.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1378 0.3824 1.3704 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 4.6869 2.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1741 4.6510 1.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7956 4.7966 0.7316 H 0 0 0 0 0 0 0 0 0 0 0 0 31 30 1 0 30 32 2 0 30 29 1 0 29 28 1 0 28 27 1 0 27 25 1 0 25 26 1 0 25 22 1 0 22 23 1 0 22 24 1 0 22 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 2 0 17 5 1 0 5 6 1 6 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 6 7 2 1 0 2 1 2 3 2 3 1 0 3 4 1 0 12 28 1 0 12 14 1 0 11 5 1 0 3 5 1 0 31 66 1 0 31 67 1 0 31 68 1 0 28 65 1 1 27 63 1 0 27 64 1 0 25 61 1 1 26 62 1 0 23 55 1 0 23 56 1 0 23 57 1 0 24 58 1 0 24 59 1 0 24 60 1 0 14 48 1 1 15 49 1 1 16 50 1 0 17 51 1 1 20 52 1 0 20 53 1 0 20 54 1 0 6 37 1 0 6 38 1 0 7 39 1 6 8 40 1 0 8 41 1 0 9 42 1 6 10 43 1 0 11 44 1 1 13 45 1 0 13 46 1 0 13 47 1 0 1 33 1 0 1 34 1 0 3 35 1 1 4 36 1 0 M END