BW0B4L -OEChem-04022105193D 39 40 0 1 0 0 0 0 0999 V2000 -0.8910 0.0581 -1.5152 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -2.8507 -0.1637 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2453 -2.1373 0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7845 -0.6285 1.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 -0.0043 -2.7222 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4018 -0.3286 -0.3957 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4045 0.6192 0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8209 -0.4791 -0.2073 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1607 2.0833 0.2643 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7228 3.1082 1.2478 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 2.3160 -1.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 -1.8834 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5096 -0.4111 0.6769 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8562 -0.0943 -1.6533 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8727 -0.2010 0.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9458 -0.2175 0.9754 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3418 -0.0156 0.5447 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8931 1.2657 0.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1107 -1.1061 0.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2133 1.4565 0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4309 -0.9154 -0.2695 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9822 0.3660 -0.2708 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0284 0.4946 1.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4895 0.4636 0.7767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3031 -0.3889 -1.1888 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0803 2.2586 0.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2785 2.9725 2.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 4.1296 0.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8087 3.0070 1.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2797 1.7264 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6745 3.3672 -1.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 2.0682 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8353 -0.3893 2.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6457 -3.7433 0.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3062 2.1253 0.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6951 -2.1109 0.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6426 2.4541 0.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0297 -1.7644 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0102 0.5145 -0.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 12 1 0 0 0 0 2 34 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 14 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$