B6XQ9B -OEChem-04022107433D 44 45 0 1 0 0 0 0 0999 V2000 2.5350 2.1117 0.2506 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9782 2.5282 -1.0663 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6349 3.0216 1.3757 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -1.2963 -1.8976 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5976 -0.5978 0.0807 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1407 -2.5218 -0.5146 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4260 -2.0673 1.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 0.6456 0.6622 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6823 -1.8650 0.4045 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5298 -1.7053 0.4745 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1889 -0.5168 -0.2508 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0544 -2.7652 -0.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.3597 1.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8392 1.6285 0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6285 -0.7845 -0.6438 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 1.6867 1.2509 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3263 1.1876 -1.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8366 0.8634 -0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3236 1.3043 1.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0116 0.8050 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2241 0.4653 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6225 -0.8518 0.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 1.4333 -0.4978 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -1.2009 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5184 1.0841 -0.6017 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -0.2330 -0.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6517 -1.3470 1.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6421 -0.2445 -1.1563 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5968 0.4762 1.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8887 -3.1981 -1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -2.3306 -1.2436 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 -3.5809 -0.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3332 -2.8595 0.9739 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -3.1262 2.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -1.6366 2.1882 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3945 2.0190 2.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9463 1.1403 -1.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9525 1.3533 2.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3957 0.4644 -2.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -1.4828 -2.1388 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8808 2.4655 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2956 -2.2232 0.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2567 1.8376 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9655 -0.5047 -0.4544 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 8 1 0 0 0 0 1 14 1 0 0 0 0 4 15 1 0 0 0 0 4 40 1 0 0 0 0 5 15 2 0 0 0 0 6 9 1 0 0 0 0 7 9 2 0 0 0 0 8 11 1 0 0 0 0 8 29 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 27 1 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 17 20 2 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 2 6 -1 9 1 M END $$$$