BGPS06 -OEChem-04042102373D 39 41 0 0 0 0 0 0 0999 V2000 5.1679 -1.3078 -0.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -1.6514 0.2007 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -2.3697 -1.3368 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4662 0.2723 -0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7853 -0.2309 0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7699 -1.0400 0.9176 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6374 0.4965 -0.5327 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6159 1.2068 2.0335 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1165 -1.0748 0.4608 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4136 0.6402 0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1492 1.6328 -0.7506 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8203 0.5455 0.5556 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4241 -0.2535 0.7523 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3423 0.6952 -0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4709 1.6421 -1.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7003 -0.2506 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0375 -0.3188 0.2061 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7896 2.6240 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3236 1.2482 1.6388 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8468 -0.5602 0.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4414 0.4223 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8168 -0.2320 -1.9349 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3219 -0.6518 -0.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5005 -1.4844 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1028 -1.0186 1.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8944 2.3670 -1.7193 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3405 -0.8100 -1.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 3.2363 -0.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2655 3.3088 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5591 2.1141 -1.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6893 1.8888 2.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4706 0.4191 1.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5347 -0.8010 -2.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 0.1077 -2.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3151 0.6140 -1.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -1.8631 1.1017 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4208 -1.0816 -0.1318 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3676 -2.5154 -0.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5834 -1.4663 1.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 17 1 0 0 0 0 1 22 1 0 0 0 0 4 23 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 20 2 0 0 0 0 7 14 2 0 0 0 0 7 20 1 0 0 0 0 8 19 2 0 0 0 0 8 21 1 0 0 0 0 9 20 1 0 0 0 0 9 23 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 16 2 0 0 0 0 12 19 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 21 2 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$