BP4JD9 -OEChem-04012115562D 67 72 0 0 0 0 0 0 0999 V2000 7.2788 -1.6693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3479 1.1786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 4.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5878 0.8998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.0908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5388 -0.4092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3006 2.0588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.6412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6607 3.7530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -0.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 0.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -0.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 0.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5878 -0.7182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5388 0.5908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2788 1.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3479 -0.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9479 2.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2433 -1.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2614 -0.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6389 3.5451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9916 3.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0523 -2.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0704 -1.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9659 -2.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7749 -2.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6704 -3.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6885 -2.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4794 -4.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4975 -2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3929 -3.9359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 -1.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 1.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 1.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 -1.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 1.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 1.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 0.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 0.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5544 2.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6769 -2.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3262 0.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3852 3.1388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9875 -3.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6368 -0.9259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4691 4.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.4008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -3.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -3.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1040 -4.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7533 -1.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4146 -4.9592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0639 -2.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8945 -4.3003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 2 0 0 0 0 3 25 2 0 0 0 0 4 10 1 0 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 19 1 0 0 0 0 7 18 1 0 0 0 0 7 26 2 0 0 0 0 8 20 1 0 0 0 0 8 32 2 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 14 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 17 20 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 21 2 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 21 25 1 0 0 0 0 21 50 1 0 0 0 0 22 27 1 0 0 0 0 22 51 1 0 0 0 0 23 28 2 0 0 0 0 23 52 1 0 0 0 0 24 30 1 0 0 0 0 24 31 1 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 34 1 0 0 0 0 30 33 2 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 35 63 1 0 0 0 0 36 38 2 0 0 0 0 36 64 1 0 0 0 0 37 39 2 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 38 66 1 0 0 0 0 39 67 1 0 0 0 0 M END $$$$