D04LJH -OEChem-04152122302D 42 45 0 1 0 0 0 0 0999 V2000 8.1398 2.4978 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1093 1.4486 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.6905 0.4552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2678 -0.4511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7408 3.0066 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4820 2.0407 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0042 3.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8809 1.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7673 2.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1343 2.3932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5465 3.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6867 0.5423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2602 -0.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8376 -1.1831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8414 -1.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4188 -2.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4226 -2.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9924 -2.9957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5698 -3.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5736 -3.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7268 2.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5001 1.4209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 4.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 4.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 0.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4749 1.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 2.9771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1815 2.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0695 1.7766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7509 2.3284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1991 3.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1129 3.1591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 3.9777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9801 3.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8779 -0.2228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1932 -1.6910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -1.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -2.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3824 -3.2241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9254 -4.4099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3116 -4.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 15 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 20 2 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 M CHG 1 1 1 M END $$$$