B2KF1P -OEChem-04012120122D 57 59 0 1 0 0 0 0 0999 V2000 15.0706 0.3047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0706 -1.3047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3923 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6542 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8554 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7817 -0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1803 -1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6569 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8598 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8598 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6569 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 0.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 0.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9642 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9642 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -0.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 20 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 10 1 0 0 0 0 2 22 1 0 0 0 0 3 18 2 0 0 0 0 6 23 2 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 7 38 1 0 0 0 0 8 17 1 0 0 0 0 8 20 2 0 0 0 0 9 19 1 0 0 0 0 9 21 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 45 1 0 0 0 0 11 20 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 26 2 0 0 0 0 21 29 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 28 2 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 27 30 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 49 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$