RDKit 3D 49 54 0 0 0 0 0 0 0 0999 V2000 -2.7084 3.6722 -0.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8338 3.3365 0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6837 2.0061 0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3944 1.0142 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2517 1.3740 -0.7487 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4432 2.6811 -1.1563 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9548 0.2369 -1.2589 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2426 -0.8405 -0.5938 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4981 -0.3496 0.5341 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5368 -1.2762 1.0443 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6961 -1.7401 -0.0171 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1225 -1.6808 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3611 -1.3328 -1.5875 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.2693 -2.0137 -2.2652 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7603 -0.7811 2.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5257 -0.4840 2.4376 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7499 -0.1431 3.7485 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 -0.1897 4.4058 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4362 -0.5971 3.5193 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6482 -0.5457 1.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7235 -1.4074 1.7586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7858 -1.5116 0.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7845 -0.7479 -0.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7124 0.1012 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6609 0.2209 0.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6178 0.8452 -1.7322 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6424 0.5232 -2.6845 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9761 0.2552 -2.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8631 -0.8810 -1.1393 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8225 4.7133 -0.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2807 4.1255 1.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0336 1.8139 1.7906 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1348 2.9307 -1.9538 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8992 0.3113 -0.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9422 -1.6348 -0.3072 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0731 -2.1674 1.3982 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2361 -2.0775 0.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -1.1328 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7051 -2.2210 -2.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5513 -1.9862 -3.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8775 -1.5296 3.8846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1988 0.1865 3.4924 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7518 -1.9944 2.6767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -2.1671 1.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 0.9202 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7307 1.3680 -3.3747 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -0.3515 -3.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7438 0.0302 -2.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3128 1.1183 -1.4180 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 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 10 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 16 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 6 1 1 0 9 4 1 0 13 8 1 0 19 15 1 0 25 20 1 0 29 23 1 0 1 30 1 0 2 31 1 0 3 32 1 0 6 33 1 0 7 34 1 0 8 35 1 1 10 36 1 1 11 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 19 41 1 0 19 42 1 0 21 43 1 0 22 44 1 0 25 45 1 0 27 46 1 0 27 47 1 0 28 48 1 0 28 49 1 0 M CHG 1 13 1 M END