LJ7O3D -OEChem-05022321302D 52 54 0 1 0 0 0 0 0999 V2000 10.6433 3.3523 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.4299 2.4786 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2212 3.6204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2236 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 3.3992 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.4059 0.8796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5559 0.6979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3968 2.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8078 -1.6204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9572 1.7160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2719 -1.6204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1379 -0.1204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6738 -3.1204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5399 1.3796 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4353 2.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6263 0.9729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4572 2.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9627 1.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3749 2.4205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4059 -0.1204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3804 2.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5399 -0.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2719 -0.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9736 1.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7926 3.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5399 -1.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9791 1.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7981 3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4059 -2.1204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3913 2.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6738 -2.1204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 2.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8078 -3.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0598 1.7173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1247 0.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9363 0.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6488 3.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8908 2.8342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9321 2.6923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 3.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0029 -0.3104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3381 0.9008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0448 3.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7269 0.7315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4336 3.5220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4059 -2.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6749 -0.4304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1379 0.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2108 -3.4304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4978 -3.0835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2709 -3.9304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1178 -4.1573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 15 1 0 0 0 0 3 32 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 14 6 1 1 0 0 0 6 20 1 0 0 0 0 7 18 2 0 0 0 0 8 30 1 0 0 0 0 8 32 1 0 0 0 0 9 31 2 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 23 1 0 0 0 0 11 29 2 0 0 0 0 12 23 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 31 1 0 0 0 0 13 33 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 15 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 21 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 2 0 0 0 0 22 41 1 0 0 0 0 24 27 1 0 0 0 0 24 42 1 0 0 0 0 25 28 2 0 0 0 0 25 43 1 0 0 0 0 26 29 1 0 0 0 0 26 31 1 0 0 0 0 27 30 2 0 0 0 0 27 44 1 0 0 0 0 28 30 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 M END $$$$