RDKit 3D 42 43 0 0 0 0 0 0 0 0999 V2000 5.0453 -0.9091 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6004 -0.9999 -0.0832 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5837 -0.3570 1.3029 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2362 1.1191 1.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7643 1.1332 0.6954 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5467 0.0058 -0.3012 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5089 0.4407 -1.2991 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7456 0.7334 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 1.9531 -0.2096 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8287 -0.1884 -0.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7669 -1.5155 -0.6928 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6609 -2.0336 -1.3602 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8015 -2.3970 -0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9259 -1.9821 0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9787 -2.8716 0.4869 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0191 -0.6867 0.6094 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9841 0.2104 0.3518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1696 1.5940 0.8086 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5135 2.5368 -0.3072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6332 2.0827 -1.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6957 3.8725 -0.0662 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7419 -0.3048 -0.9043 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5665 -0.0586 -0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5536 -1.8298 -0.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0945 -0.7613 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3223 -2.0755 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7807 -0.7581 1.9324 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5774 -0.4564 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 1.7318 1.9676 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8154 1.4862 0.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4891 2.1004 0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1676 0.9522 1.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1639 -0.8512 0.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9101 1.3882 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3859 -0.2899 -2.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5883 -2.9840 -1.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7218 -3.4368 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 -3.4035 1.3627 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -0.3563 1.1251 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3441 2.0049 1.3812 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0469 1.6119 1.5374 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0892 4.5495 -0.5211 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 8 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 6 22 1 0 22 2 1 0 17 10 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 1 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 1 7 34 1 0 7 35 1 0 12 36 1 0 13 37 1 0 15 38 1 0 16 39 1 0 18 40 1 0 18 41 1 0 21 42 1 0 M END