LA3I1V -OEChem-05022323333D 38 40 0 1 0 0 0 0 0999 V2000 -5.3753 -0.3481 0.0702 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2134 0.5071 0.0452 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5873 0.3464 -0.3059 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1156 1.4347 0.2842 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2407 -1.8727 -1.0205 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5899 -2.3202 -0.5387 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0174 -0.7188 0.5105 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8726 0.3529 -0.7160 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1665 1.4323 -1.7773 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8116 0.5206 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6495 1.4418 -2.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5404 1.5578 -0.9214 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 -0.6728 -0.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2065 -0.3752 0.4593 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6765 -0.2188 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.0844 0.5015 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7585 -1.0916 0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8334 -1.4242 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3591 -2.6299 -1.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2455 2.0321 1.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7567 -1.8697 2.2833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9694 2.8321 1.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -0.6338 -1.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5564 1.2557 -2.6711 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8861 2.4228 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6038 -0.2446 1.2403 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6417 1.4858 0.9852 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8524 2.2717 -2.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8871 0.5133 -2.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3884 2.5236 -0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5922 1.5038 -1.2193 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8446 -1.8626 1.4197 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -3.6209 -1.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 0.1913 0.9209 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7797 -1.3810 0.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5075 -2.6577 2.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7652 -1.4725 2.3206 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6119 3.5413 2.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 4 16 2 0 0 0 0 5 13 1 0 0 0 0 5 19 2 0 0 0 0 6 17 2 0 0 0 0 6 19 1 0 0 0 0 7 17 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 20 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 3 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$