D0I3BL -OEChem-04152109583D 57 62 0 1 0 0 0 0 0999 V2000 2.5930 2.7924 1.6355 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1586 -3.2214 -0.5493 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4617 -3.3324 1.9839 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0725 2.5964 -1.0924 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9676 -2.3995 0.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1138 -0.7013 0.3962 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6061 -0.6481 -1.4283 N 0 0 1 0 0 0 0 0 0 0 0 0 1.1454 -1.1151 0.1376 N 0 0 2 0 0 0 0 0 0 0 0 0 0.7782 1.9413 0.4087 N 0 0 1 0 0 0 0 0 0 0 0 0 2.6154 0.3982 -1.1951 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1969 -0.1502 -0.9666 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1459 1.0265 0.1079 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6423 -1.3523 -0.1461 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2766 1.0577 -0.6532 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9263 -0.1425 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0512 1.5938 1.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2927 -2.0305 0.2273 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1936 -1.6741 0.3912 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1216 0.5613 -0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9619 3.3339 0.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.6953 0.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4079 -1.4551 -2.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7159 3.8549 1.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2568 -2.1229 1.8634 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2588 1.4833 -0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7289 -1.2076 0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6341 1.0265 -0.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8438 -0.2382 0.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7242 2.0487 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7263 -1.2286 -0.7637 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6228 1.1370 -2.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8447 -0.6334 -1.8886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8709 1.8135 -0.1444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4679 -2.0719 -0.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2134 1.6225 -1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.0927 0.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6559 -0.3280 1.8084 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8465 0.9090 1.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4118 -2.3451 1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3357 -2.5390 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0251 3.8755 -0.1246 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 3.4259 -0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4887 -0.8265 -3.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4438 -1.9673 -2.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1959 -2.2121 -2.6934 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3048 4.7483 1.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 4.0724 2.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2763 -2.3131 2.2096 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1831 -1.3734 2.5326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9391 -3.7753 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4299 -3.5953 2.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4862 2.9455 0.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6967 1.6902 -0.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8334 2.3365 -1.4749 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 -1.5769 -0.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1706 -2.0862 -1.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8394 -0.4680 -1.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 23 1 0 0 0 0 2 17 1 0 0 0 0 2 50 1 0 0 0 0 3 24 1 0 0 0 0 3 51 1 0 0 0 0 4 25 2 0 0 0 0 5 26 2 0 0 0 0 6 28 1 0 0 0 0 6 30 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 32 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 19 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 21 1 0 0 0 0 18 24 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 25 1 0 0 0 0 20 23 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 26 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$