BP68NK -OEChem-04022118203D 27 29 0 0 0 0 0 0 0999 V2000 0.9161 1.0422 1.3547 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2126 1.0423 -1.4281 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1803 -2.3957 -0.2863 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4184 -0.5476 0.9483 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3547 1.7771 0.2875 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8438 -1.0513 1.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0087 -0.4933 0.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4723 -0.4246 -0.1637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2982 -1.2579 0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4094 0.8317 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9916 0.2410 1.3398 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1084 -0.7086 -0.6986 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5654 -0.7703 -0.9353 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0741 0.7596 0.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1909 -0.1902 -1.4092 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5694 0.1810 -1.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1737 0.5439 -0.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4193 1.4207 -0.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9163 -0.8276 2.5125 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8562 -2.1441 1.3469 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9269 0.4175 2.4101 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -1.2846 -1.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6486 -1.7440 -1.4048 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8393 1.3315 1.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2697 -0.3591 -2.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4498 -0.0361 -1.6895 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1838 2.1843 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 17 1 0 0 0 0 3 9 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 5 18 2 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 11 14 1 0 0 0 0 11 21 1 0 0 0 0 12 15 2 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 17 2 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$