LJC45D -OEChem-05032301333D 36 39 0 1 0 0 0 0 0999 V2000 4.7644 2.6128 0.0862 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.7271 2.8973 0.1068 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6897 -0.0436 -0.4127 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -1.7536 0.2037 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3559 -2.3900 -0.1871 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8415 -3.3830 0.1382 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1228 -0.1776 -0.5613 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7243 1.0983 -1.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8008 -0.2779 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8664 2.0466 0.0464 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9245 1.1623 1.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8322 -1.1434 -0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5454 -0.9691 -0.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4484 0.1345 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3004 -2.1203 0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 -0.3851 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 1.5305 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8734 0.4245 0.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4979 -3.4190 -0.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4287 2.3513 -0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6965 1.8046 0.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -1.0313 -1.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7215 0.8705 -1.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1169 1.5190 -1.9522 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2657 -0.9072 1.5172 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8058 -0.7006 0.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7533 2.6800 -0.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 1.2939 1.8312 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1128 1.3976 1.9937 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2961 0.8854 -0.3749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8323 3.4696 0.8861 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3828 -2.3936 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3294 1.9972 -0.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8615 0.0004 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9486 -4.4051 0.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3164 3.4276 -0.2508 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 10 1 0 0 0 0 2 31 1 0 0 0 0 3 7 1 0 0 0 0 3 12 1 0 0 0 0 3 30 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 4 32 1 0 0 0 0 5 12 2 0 0 0 0 5 19 1 0 0 0 0 6 15 1 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 M END $$$$