RDKit 3D 76 81 0 0 0 0 0 0 0 0999 V2000 -7.8526 1.8572 -0.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9272 1.1344 -1.0961 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2207 0.2283 -0.3361 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7478 0.6053 -0.2778 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0421 -0.4440 0.5030 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6817 -0.2531 0.6352 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2386 -0.0675 1.9196 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2439 -1.1002 2.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.7477 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4143 0.1170 0.8959 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1040 -0.7129 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4425 1.3095 1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1416 2.3937 0.3769 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9961 2.4901 -0.5405 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 1.5080 -0.3268 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4545 0.7382 -1.5583 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6154 0.8968 -2.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5538 -0.0241 -1.5863 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8939 0.1231 -1.7379 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4339 -1.2220 -2.2587 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8008 -0.9688 -2.1556 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9907 -0.4683 -0.8700 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2474 0.3311 -0.8459 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9906 -1.5896 -0.0114 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -1.3911 0.9564 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3017 -0.3049 0.6994 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1836 0.2292 1.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8699 -0.3855 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8354 0.6609 0.8597 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7469 0.3341 -0.5419 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5804 1.2935 1.9757 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2402 -1.7331 0.0788 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0739 -1.9157 -0.9828 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4159 -1.6930 -2.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3897 -1.1656 -0.8666 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1705 -1.8786 0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4140 2.5821 -0.9687 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2902 2.4654 0.4099 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5420 1.2152 0.2269 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5923 0.3194 0.7144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4061 0.7656 -1.2936 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7019 1.5568 0.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 -0.3929 1.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0556 -0.0991 2.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 -2.0640 1.8104 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -1.3556 3.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6935 -1.7382 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6293 -0.3343 3.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0656 -1.1172 -0.7515 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5096 -0.1771 -1.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4498 -1.6462 -0.0443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7816 3.2574 0.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 2.3062 -1.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3436 3.5441 -0.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0258 2.1204 -0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2406 0.8480 -2.5102 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1078 -2.0395 -1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1658 -1.3935 -3.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3982 0.8919 0.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2792 1.0084 -1.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 -0.3771 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9388 -2.0673 1.8193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4098 0.1352 2.6193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2017 1.3448 1.3525 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5251 -0.9347 2.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9464 -1.1643 0.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 1.3583 1.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0373 1.4031 -0.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3048 1.5688 3.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3539 2.0486 1.6335 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3719 -3.0080 -0.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4057 -1.2056 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0728 -1.1444 -3.0328 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1843 -2.6664 -2.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8722 -1.1893 -1.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2978 -2.8102 -0.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 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 6 10 29 1 0 29 28 1 0 28 27 1 0 27 26 1 0 26 25 2 0 25 24 1 0 24 22 1 0 22 23 1 6 22 21 1 0 21 20 1 0 20 19 1 0 19 18 1 0 18 16 1 0 16 17 2 0 16 15 1 0 15 14 1 0 14 13 1 0 13 12 2 0 12 31 1 0 19 30 1 0 5 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 3 1 0 31 7 1 0 12 10 1 0 15 29 1 0 30 26 1 0 30 22 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 1 4 41 1 0 4 42 1 0 5 43 1 1 7 44 1 1 8 45 1 0 8 46 1 0 9 47 1 0 9 48 1 0 11 49 1 0 11 50 1 0 11 51 1 0 29 67 1 1 28 65 1 0 28 66 1 0 27 63 1 0 27 64 1 0 25 62 1 0 23 59 1 0 23 60 1 0 23 61 1 0 20 57 1 0 20 58 1 0 19 56 1 6 15 55 1 1 14 53 1 0 14 54 1 0 13 52 1 0 31 69 1 0 31 70 1 0 30 68 1 1 33 71 1 6 34 72 1 0 34 73 1 0 34 74 1 0 35 75 1 6 36 76 1 0 M END