RDKit 3D 45 46 0 0 0 0 0 0 0 0999 V2000 1.9252 -2.9840 -0.7064 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -2.0948 0.1781 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8298 -0.9563 0.6803 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -0.9691 0.4384 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6998 0.4401 -0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4781 1.5111 0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1412 2.1589 0.9803 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7163 2.7858 -0.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5625 2.8427 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7401 2.2885 -0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6656 3.1629 -0.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0088 0.9209 -0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 0.3641 -0.1337 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4551 1.1031 0.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 0.5778 0.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8435 1.3849 0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9274 -0.7551 0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8154 -1.5145 -0.2845 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0671 -2.8865 -0.5149 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5364 -1.0132 -0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3966 -1.9078 -0.7093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8202 -2.9154 -1.4199 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1258 -1.8558 -0.4288 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -3.7978 -1.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3307 -2.4377 -1.5606 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6841 -3.5206 -0.1025 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 -2.7652 1.0765 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5003 -0.0723 0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5463 -0.7386 1.7267 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6858 -1.7560 -0.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.0488 1.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7556 0.4114 -0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1039 0.6355 -1.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2262 2.3300 0.6908 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7869 1.1046 1.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3575 3.0576 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3749 1.6345 1.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5855 3.2920 -0.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5724 3.4441 -1.8341 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4053 0.2889 -0.9456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 0.6694 0.7961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4086 2.1792 0.3897 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3208 1.8170 -0.2206 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9242 -1.1793 0.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -3.2360 -0.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 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 1 0 15 17 2 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 2 1 0 20 13 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 1 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 12 40 1 0 12 41 1 0 14 42 1 0 16 43 1 0 17 44 1 0 19 45 1 0 M END