LJT8F4 -OEChem-05032301122D 42 45 0 1 0 0 0 0 0999 V2000 2.0000 1.9490 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4282 -0.9993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7882 -2.8941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.4483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3697 -0.4095 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.7102 0.7466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5047 2.8615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3291 2.5060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0692 -1.5535 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7297 -2.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3892 -0.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7102 -2.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0302 -1.1603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0887 -1.7501 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6897 0.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0047 1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7687 -2.6975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0047 1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3137 2.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6957 2.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3197 0.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 1.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6803 2.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2992 0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9773 1.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7972 -2.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2001 -2.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9553 -2.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3747 0.0137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7763 -0.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7246 -2.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3231 -2.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5742 -1.4577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4175 -0.6762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4808 -1.8720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8203 -1.1211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5047 3.4815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5181 -0.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 1.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4955 3.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8861 0.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 -3.4815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 14 2 1 1 0 0 0 2 36 1 0 0 0 0 3 17 1 0 0 0 0 3 42 1 0 0 0 0 4 17 2 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 6 22 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 37 1 0 0 0 0 8 19 1 0 0 0 0 8 22 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 6 0 0 0 10 12 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 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$