RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 3.7906 1.0188 1.1483 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5455 0.7612 -0.3276 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0341 -0.5929 -0.5767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9102 -1.5889 -1.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5076 -2.8353 -1.2398 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2324 -3.1386 -0.9917 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3247 -2.2003 -0.5356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7122 -0.8805 -0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6852 0.0007 0.1374 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7047 1.4646 -0.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7929 1.7899 0.1538 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9848 2.2873 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 2.6205 -0.8045 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 3.8419 -0.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4891 0.5117 0.0189 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5803 -0.3301 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7929 -0.0281 0.8885 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7613 -1.0146 1.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5311 -2.2650 0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3264 -2.5434 -0.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3461 -1.6030 -0.2214 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0103 -1.6493 -0.8355 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0936 -2.6527 -0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5319 -0.2758 -0.7749 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2692 2.0084 1.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9085 0.8689 1.7628 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5628 0.2650 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0779 1.5769 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6049 0.7742 -0.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9528 -1.3353 -1.2396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9263 -4.1775 -1.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3636 -0.1700 1.1846 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2258 2.1060 0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8023 1.7150 -1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9926 1.5293 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1463 2.9955 1.8102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9013 2.9073 1.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2597 4.3851 -1.7506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3314 3.7074 -1.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7759 4.4600 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9873 0.9655 1.2665 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6965 -0.7652 1.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2801 -3.0272 0.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1865 -3.5434 -0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0857 -1.9245 -1.9399 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2329 -2.6606 0.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2311 -3.6342 -0.7045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4278 0.2755 -1.7278 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 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 6 13 14 1 0 11 15 1 0 15 24 1 0 24 22 1 0 22 23 1 0 22 21 1 0 21 20 2 0 20 19 1 0 19 18 2 0 18 17 1 0 17 16 2 0 8 3 1 0 24 9 1 0 16 21 1 0 23 7 1 0 16 15 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 4 30 1 0 6 31 1 0 9 32 1 1 10 33 1 0 10 34 1 0 12 35 1 0 12 36 1 0 12 37 1 0 14 38 1 0 14 39 1 0 14 40 1 0 24 48 1 6 22 45 1 6 23 46 1 0 23 47 1 0 20 44 1 0 19 43 1 0 18 42 1 0 17 41 1 0 M END