RDKit 3D 31 32 0 0 0 0 0 0 0 0999 V2000 4.5300 0.8942 -1.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6451 0.1323 -0.5036 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9097 -1.1916 -0.1764 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6244 0.7356 -0.0184 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7073 0.0758 0.8837 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0211 1.0239 1.8147 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3187 0.7517 1.8226 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6038 -0.0277 0.7643 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9432 -0.3606 0.3525 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9706 0.2448 1.2369 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8632 -0.4167 1.8074 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9517 1.6244 1.4524 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2503 0.1053 -1.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -0.7966 -1.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9481 -2.0805 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2145 -3.2103 -1.2913 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -1.7589 0.2857 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5608 -0.4776 0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -1.1904 -0.9058 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5271 0.4071 -1.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0613 1.0082 -2.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6692 1.9417 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2447 -1.4055 0.7469 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1848 -0.7910 1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2538 2.0806 1.5531 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4199 0.8530 2.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3724 2.1933 0.7258 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5069 1.1656 -1.1196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4428 -0.2189 -1.7324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2899 -0.4676 -0.7354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6689 -0.8438 -2.4384 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 18 1 0 18 19 2 0 8 9 1 0 9 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 9 10 1 1 10 12 1 0 10 11 2 0 18 5 1 0 17 9 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 5 24 1 1 6 25 1 0 6 26 1 0 13 28 1 0 13 29 1 0 14 30 1 0 14 31 1 0 12 27 1 0 M END