RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 4.1129 -2.6308 -1.1839 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2134 -1.8441 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0149 -0.5767 -0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7091 -0.0988 -0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6013 -0.8877 -0.4337 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8145 -2.1556 -0.9769 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3246 -0.3331 -0.2157 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1049 -0.9646 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0896 -2.1528 -0.5403 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.0635 -0.1309 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3188 -0.4889 -0.2634 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7309 -0.5762 -1.7357 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -1.0468 -1.9004 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0415 -0.8708 -0.6469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 0.3503 0.0449 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2693 0.4566 0.5067 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5914 0.9007 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8639 0.4698 0.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7512 1.0392 1.7115 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4267 2.0304 2.5991 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1121 2.4138 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1915 1.8719 1.7582 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1547 0.3082 0.0848 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3761 -0.3477 0.6158 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4025 0.4424 0.9398 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2987 1.9030 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2413 2.6343 1.0536 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0974 2.3654 0.3039 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0248 1.5955 -0.0449 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2592 -3.6157 -1.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2091 -2.2272 -1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5664 0.8953 0.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9862 -2.7969 -1.2649 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2962 0.5867 0.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7254 0.8799 -0.4312 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -1.4926 0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0648 -1.2428 -2.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6209 0.4135 -2.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -0.4960 -2.7366 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1947 -2.1042 -2.1913 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0881 -0.8635 -0.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9166 -1.7328 0.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1798 0.2195 1.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9335 1.4940 0.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7650 0.6574 1.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1523 2.4768 3.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 3.1931 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4173 -1.4177 0.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3315 0.0629 1.3434 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9991 3.3670 0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 3 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 6 1 1 0 16 11 1 0 22 17 1 0 29 23 2 0 1 30 1 0 2 31 1 0 4 32 1 0 6 33 1 0 7 34 1 0 10 35 1 0 11 36 1 1 12 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 16 44 1 0 19 45 1 0 20 46 1 0 21 47 1 0 24 48 1 0 25 49 1 0 28 50 1 0 M END