D0G9NE -OEChem-10101305022D 44 46 0 1 0 0 0 0 0999 V2000 3.4030 -2.3465 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9043 -0.1293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.4805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -3.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 0.4087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.8465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 1.5655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -0.5418 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5256 1.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 2.3098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8363 2.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1899 3.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -1.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1684 3.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -2.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 0.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9404 1.4376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -0.1024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3323 2.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4967 1.8219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5462 1.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1394 1.6843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1693 3.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5761 3.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3832 2.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2188 3.2101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9917 -1.7612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9917 -0.9318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6948 3.7942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9372 4.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -2.7182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4846 -2.4605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8439 0.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 17 2 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 5 39 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 17 1 0 0 0 0 7 23 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 20 1 0 0 0 0 19 22 2 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$