BWS68L -OEChem-04022103103D 36 37 0 0 0 0 0 0 0999 V2000 -4.4720 -2.1500 -0.5215 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0689 0.5766 -2.5908 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 0.1485 2.3544 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0375 0.2054 0.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4938 2.7977 0.1924 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8039 -0.8295 0.5887 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4885 1.8205 0.0569 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8508 -0.5160 0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5265 -1.1567 0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5237 -0.1893 0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9225 -0.0048 -0.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1809 -1.8105 -0.2473 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8567 -2.4513 -0.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1837 -2.7782 -0.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6489 0.4643 -1.3625 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -0.1116 0.9808 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5083 -0.3910 -0.4095 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8721 0.2508 1.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8766 0.5087 0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9871 0.8267 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5985 0.7198 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9225 4.0701 -0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2401 0.8037 0.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -3.2124 -0.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4341 -3.7886 -0.6822 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9827 -0.4748 1.8447 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0575 -0.2920 -1.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5652 1.1939 -2.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6411 1.0039 0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 2.1289 -0.2429 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0482 -1.3706 -0.4806 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7253 0.9179 -3.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8221 -0.1921 2.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5448 4.1102 -1.1065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1188 4.2906 0.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7027 4.8279 0.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 31 1 0 0 0 0 2 15 1 0 0 0 0 2 32 1 0 0 0 0 3 18 1 0 0 0 0 3 33 1 0 0 0 0 4 19 2 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 9 1 0 0 0 0 6 17 2 0 0 0 0 7 19 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 23 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 20 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 21 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 29 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$