RDKit 3D 53 55 0 0 0 0 0 0 0 0999 V2000 2.3005 -1.0065 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1038 -0.1607 2.7752 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 0.7895 3.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 1.5733 2.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6014 1.4150 1.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6881 0.4974 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9616 -0.3095 1.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5531 0.2927 -0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4453 1.0166 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1586 0.1921 -1.5375 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1117 -1.0120 -1.3032 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0949 0.9769 -1.9776 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1709 0.4562 -2.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0471 0.8780 -3.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1076 -0.0627 -3.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8554 -1.0218 -2.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8361 -0.5349 -1.5187 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5853 -0.9199 -0.1248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 0.2344 0.7883 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8209 0.1302 2.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4186 -1.2589 2.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7957 -1.4615 0.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5321 -2.3362 -2.1412 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2116 -0.0671 -4.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8324 1.9945 -4.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6227 2.9085 -4.7782 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 2.2441 0.1467 N 0 0 0 0 0 4 0 0 0 0 0 0 6.6241 2.1966 0.2774 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7807 2.9762 -0.6454 O 0 0 0 0 0 1 0 0 0 0 0 0 2.9660 -1.5537 4.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6281 -0.3745 4.3108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -1.7401 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1203 0.9159 4.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4747 2.2948 2.8113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2895 -1.0686 0.9868 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2156 1.9163 -0.7868 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7436 1.3488 -2.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 1.8205 -2.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8358 -1.7181 -0.1646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.1275 0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2512 1.2306 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1594 0.3019 2.9773 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 0.8815 2.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6688 -1.9979 2.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2801 -1.3424 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7084 -0.8972 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9823 -2.5219 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4091 -2.2362 -1.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8493 -3.0795 -1.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8724 -2.7322 -3.1035 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5788 0.9486 -4.4804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0607 -0.6659 -3.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8611 -0.4791 -5.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 16 23 1 0 15 24 1 0 14 25 1 0 25 26 3 0 5 27 1 0 27 28 2 0 27 29 1 0 7 2 1 0 17 13 1 0 22 18 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 4 34 1 0 7 35 1 0 9 36 1 0 9 37 1 0 12 38 1 0 18 39 1 0 19 40 1 0 19 41 1 0 20 42 1 0 20 43 1 0 21 44 1 0 21 45 1 0 22 46 1 0 22 47 1 0 23 48 1 0 23 49 1 0 23 50 1 0 24 51 1 0 24 52 1 0 24 53 1 0 M CHG 2 27 1 29 -1 M END