6360 -OEChem-10171923503D 14 13 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 -0.3603 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5345 1.3473 0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4342 -0.2109 0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8997 -1.1365 0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 -1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5557 1.4007 1.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0922 2.1671 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5526 1.5147 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -0.2192 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0882 0.5872 -0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8308 -1.1634 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9354 -1.1816 1.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5355 -2.1020 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -1.0036 -0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 M END > 6360 > 0.4 > 1 > 0 > 0 > 1 4 1 2 3 4 hydrophobe > 4 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 000018D800000001 > -0.4775 > 5.074 > 139733 1 9655039756538135470 20096714 4 17622157971364819080 21015797 1 9655568625867858918 5943 1 13485114874618043416 > 82.32 1.4 1.4 0.66 0.57 0.04 -0.01 -0.04 0.09 -0.57 0.09 0 0 0 > 133.497 > 59.4 > 2 5 10 $$$$