RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 5.0448 0.3275 0.0834 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 0.0113 -1.3425 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8212 0.4494 -2.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5165 0.6680 -1.8954 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2738 0.3032 -1.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2383 -0.6198 -0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.9540 0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0775 -0.3086 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0603 0.6276 -0.8927 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1006 0.9026 -1.5066 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2541 1.3570 -1.3488 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5426 0.7092 -0.9536 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3060 1.4976 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6131 1.5846 1.4029 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9687 2.9804 1.4605 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 0.5435 1.7321 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -0.5659 0.7611 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3221 -1.8185 1.4133 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3217 -3.0019 0.6935 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0429 -3.0236 -0.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -1.6808 -1.3498 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3833 -0.6507 -0.3567 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3526 -0.5429 0.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2368 0.8899 0.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 1.0274 0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7089 -1.1032 -1.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5092 0.8806 -1.5892 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 1.7750 -1.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4008 0.3551 -2.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -1.1552 0.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0586 -1.6836 1.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2373 1.4081 -2.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1852 2.4172 -1.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2371 0.5993 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5795 2.5142 -0.3193 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3006 0.9775 0.1915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4347 1.6543 2.1799 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1034 3.4538 2.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3486 3.6413 0.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8669 2.8732 1.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6573 1.0358 2.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9498 0.0599 2.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4091 -1.8323 2.4296 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8263 -3.7991 1.3212 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3115 -3.4671 0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6247 -3.7806 -1.3181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1234 -3.2107 -0.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8613 -1.5820 -1.6355 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5303 -1.7522 -2.2493 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3528 -0.9921 0.0322 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 1 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 9 10 2 0 10 5 1 0 17 8 1 0 22 17 1 0 22 12 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 1 3 27 1 0 4 28 1 0 4 29 1 0 6 30 1 0 7 31 1 0 11 32 1 0 11 33 1 0 12 34 1 6 13 35 1 0 13 36 1 0 14 37 1 1 15 38 1 0 15 39 1 0 15 40 1 0 16 41 1 0 16 42 1 0 18 43 1 0 19 44 1 0 19 45 1 0 20 46 1 0 20 47 1 0 21 48 1 0 21 49 1 0 22 50 1 1 M END