BS4LR5 -OEChem-04012112052D 41 42 0 1 0 0 0 0 0999 V2000 5.5116 0.1192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 -0.5194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 -1.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 -2.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 -1.9512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -2.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4997 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 3.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 3.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 1.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 2.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 3.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 1.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.7494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.5225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -1.9019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5446 -1.4904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4987 -2.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3743 -2.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0172 -3.1246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6986 -2.5728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1468 -1.8914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9981 -2.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1353 -3.7141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0013 -3.5769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 16 1 0 0 0 0 2 12 2 0 0 0 0 3 16 2 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 1 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 M END $$$$