6427498 OpenBabel04211813443D 45 46 0 0 0 0 0 0 0 0999 V2000 5.4267 -4.2563 -0.1118 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7665 -5.8188 -0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8909 3.4600 1.0906 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1852 2.7651 0.5933 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5548 4.7723 -0.5672 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2753 4.9399 0.9863 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7393 3.3275 0.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4424 3.5769 -0.6169 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1799 4.3063 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9591 1.2329 0.3925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3499 2.9654 1.5879 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5963 3.5894 -1.2844 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2051 0.4646 -0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8319 -0.9876 -0.1725 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7525 -1.9504 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3051 -3.3819 -0.2352 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2192 -1.6170 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9765 -5.5753 -0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9588 -6.7011 0.0524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5948 3.0777 2.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9449 5.6419 -1.1128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4611 5.6264 1.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1564 5.2107 1.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6633 2.3068 -0.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2153 3.6286 0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 5.1428 -1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 3.7960 -2.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6485 0.8061 1.3461 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1649 1.0988 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2416 2.4661 1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0795 2.5413 2.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5515 4.0305 1.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4288 2.9728 -0.9454 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7073 4.2161 -2.1693 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5019 0.8247 -1.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0282 0.6026 0.6034 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7777 -1.2621 -0.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8036 -3.5724 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6127 -3.5674 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 -2.5370 -0.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4303 -1.0806 0.7982 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4877 -0.9916 -0.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -7.6514 0.0556 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5106 -6.5918 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6556 -6.6792 -0.7856 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 2 18 2 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 20 1 1 0 0 0 4 8 1 0 0 0 0 4 10 1 6 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 6 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 12 2 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 M END