B4P9TV -OEChem-04022115343D 42 44 0 0 0 0 0 0 0999 V2000 -1.6551 3.0006 -0.7454 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2105 3.3339 0.2275 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8769 1.8392 0.5621 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2706 -1.3459 -1.9597 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5231 -2.7446 0.3072 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2894 -1.6508 -0.3576 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1944 0.0674 0.6662 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9425 1.6909 -0.1978 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0106 1.3467 1.1791 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6966 1.7672 1.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8064 0.8116 -0.5952 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2041 -0.4718 0.0928 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7001 -0.6359 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3195 -1.1928 0.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8255 0.7930 0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4262 -1.0117 -1.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -1.8939 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1344 -1.5315 -0.9228 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7359 -2.2328 0.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6292 -2.4140 1.2712 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6235 1.9137 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3826 2.6302 0.3436 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7571 -0.6181 -3.0858 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8507 -3.4481 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 1.8912 0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0075 0.2402 -0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -0.1337 -0.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0356 -0.6567 -1.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3985 -1.2879 0.5039 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6232 0.8159 1.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8583 1.1342 0.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7926 -0.4683 -1.8695 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6076 -2.0385 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 2.1590 -1.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3891 -2.9461 2.1851 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0612 -0.5653 -3.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0117 0.4133 -2.8216 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5843 -1.1406 -3.5781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8881 -3.7847 1.4055 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2351 -4.3458 1.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8117 -2.7925 2.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6146 -1.0909 -1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 22 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 18 1 0 0 0 0 4 23 1 0 0 0 0 5 19 1 0 0 0 0 5 24 1 0 0 0 0 6 12 1 0 0 0 0 7 12 2 0 0 0 0 8 15 1 0 0 0 0 8 21 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 22 2 0 0 0 0 11 25 2 0 0 0 0 11 27 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 26 27 2 0 0 0 0 27 42 1 0 0 0 0 M CHG 2 6 -1 12 1 M END $$$$