RDKit 3D 52 52 0 0 0 0 0 0 0 0999 V2000 4.5721 1.6946 0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2536 0.8382 -0.6109 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 1.1023 -1.9276 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3927 -0.1792 -0.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -0.4488 0.8901 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2643 -0.3320 0.7328 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7309 -1.3069 -0.2726 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0826 -2.7200 0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7716 -1.0925 -0.4688 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9279 0.3196 -0.8679 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2961 0.8060 -1.2425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5995 2.1006 -0.5145 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8068 3.3201 -1.3354 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6852 2.1824 0.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4946 1.0035 1.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3494 -0.1233 1.2657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -1.2690 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0221 -2.2232 0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2174 -1.8850 0.5533 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5431 -1.6274 0.6614 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5445 -3.1379 0.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6804 -3.6046 -0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3246 2.4441 0.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9702 1.0692 1.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6387 2.2443 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4522 0.4940 -2.7366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9787 0.9780 -1.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 2.1910 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -0.7947 -1.2725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0464 0.4249 1.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1097 -1.3327 1.4222 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1686 0.7012 0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.4032 1.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1839 -1.0947 -1.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9318 -3.4083 -0.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2326 -2.6761 0.2039 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7773 -2.9975 1.1234 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0417 -1.7091 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 0.4508 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5354 1.0852 -0.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2663 1.0349 -2.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 0.0733 -1.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8499 3.1231 -2.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7568 3.8434 -1.0654 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9212 3.9964 -1.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9008 3.1291 1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4497 0.7424 1.9115 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8778 1.2889 2.7535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4435 0.0917 1.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8176 -3.2055 0.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9593 -1.4399 1.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4294 -3.7619 1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 2 3 2 1 1 0 2 3 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 17 20 1 0 20 21 1 0 21 22 2 0 20 9 1 0 8 35 1 0 8 36 1 0 8 37 1 0 7 34 1 6 6 32 1 0 6 33 1 0 5 30 1 0 5 31 1 0 4 29 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 3 28 1 0 9 38 1 6 10 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 13 43 1 0 13 44 1 0 13 45 1 0 14 46 1 0 15 47 1 0 15 48 1 0 16 49 1 0 18 50 1 0 20 51 1 1 21 52 1 0 M END