RDKit 3D 49 53 0 0 0 0 0 0 0 0999 V2000 0.1511 4.8368 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1469 3.4790 -0.0936 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8182 2.5496 0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0267 2.9509 0.1923 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4935 1.1611 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8086 0.8205 0.3821 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 1.4603 0.8002 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1093 0.5702 0.6707 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4457 0.6633 0.9852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2871 -0.4128 0.8039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8114 -1.6070 0.3038 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4757 -1.6899 -0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6195 -0.6292 0.1631 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1992 -0.5062 -0.1714 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9818 -0.5419 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3185 -1.8919 -1.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4274 -2.1504 -0.6899 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7987 -1.8556 -0.7743 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2099 -0.4386 -0.4320 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7280 -0.4383 -0.2725 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2009 -1.3511 0.8031 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2043 0.8351 -0.0392 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4972 0.1046 0.7491 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6503 -0.9738 1.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2833 -1.5269 0.3952 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7727 5.3593 -0.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9511 4.9443 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4709 5.2974 0.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 2.4600 1.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8573 1.5752 1.3772 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3392 -0.3649 1.0429 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4708 -2.4664 0.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1075 -2.6325 -0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9569 -0.5044 -2.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3052 0.2770 -1.9571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2975 -1.8529 -2.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0813 -2.6937 -1.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3668 -2.5347 -0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1492 -2.0435 -1.8169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9983 0.1848 -1.3218 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1239 -0.8172 -1.2416 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3002 -2.4020 0.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2389 -1.0105 1.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 -1.1931 1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1142 0.9666 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2063 0.5583 1.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2571 -1.7623 1.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0521 -0.4405 2.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8994 -2.3217 0.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 6 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 19 23 1 0 23 24 1 0 24 25 1 0 23 5 1 0 14 6 1 0 25 14 1 0 13 8 1 0 25 17 1 0 1 26 1 0 1 27 1 0 1 28 1 0 7 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 12 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 18 38 1 0 18 39 1 0 19 40 1 6 20 41 1 6 21 42 1 0 21 43 1 0 21 44 1 0 22 45 1 0 23 46 1 1 24 47 1 0 24 48 1 0 25 49 1 1 M END