B57UJA -OEChem-04022104083D 42 43 0 1 0 0 0 0 0999 V2000 -3.1766 2.4213 1.3785 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6359 -1.7772 0.7433 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9276 -3.0105 0.7870 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8534 1.3739 1.1925 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1443 1.6231 -0.8588 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6837 -0.3574 -0.1226 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.3598 0.4791 -0.1121 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4755 -0.2866 0.0799 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5075 1.3045 1.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2038 0.4208 -1.0175 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7485 1.8663 -1.3139 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0838 -0.5084 -0.5286 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7588 -0.1827 -2.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1535 2.5589 -0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7708 -0.2954 -0.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2486 -1.1388 -0.5065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3774 -1.5647 0.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4237 1.2762 0.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6515 -0.9088 -0.9576 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0451 -2.1951 0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -2.4079 0.7763 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8356 -0.0887 -0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6802 0.5845 0.6844 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1029 0.8135 0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6125 2.4542 -1.6582 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0326 1.9091 -2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5811 0.4237 -2.7267 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1534 -1.1936 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9848 -0.2479 -3.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1608 2.1688 0.1406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0179 3.6232 -0.3206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 0.5041 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6538 -0.2861 -1.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0831 -1.8741 -1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5867 -3.2299 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0719 0.6140 0.3384 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2853 -1.0545 -0.6543 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8372 0.5354 -1.2967 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2384 1.5488 0.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6953 -0.0361 1.5885 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3043 0.6955 1.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5433 1.9345 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 3 20 1 0 0 0 0 4 24 1 0 0 0 0 5 24 1 0 0 0 0 6 24 1 0 0 0 0 7 10 1 0 0 0 0 7 18 2 0 0 0 0 8 19 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 18 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 15 1 0 0 0 0 12 17 2 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$