BR5J8N -OEChem-04022105103D 51 56 0 0 0 0 0 0 0999 V2000 -3.6339 -0.8804 -0.4037 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -2.3597 0.3928 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0911 2.4905 1.8145 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3321 -5.1968 -1.4002 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5979 3.0498 1.0164 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2654 0.9209 0.0699 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9207 -3.0341 -0.8873 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5636 1.1147 0.3282 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7354 -3.7788 -0.5288 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3378 2.7917 1.3978 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9905 -0.0934 0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.5650 -0.3903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3457 -1.4841 -0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2349 0.7608 0.6463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9966 1.5060 -0.9393 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0522 0.9231 -1.7165 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1882 1.5196 -2.0779 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7399 0.7128 1.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -1.7902 -0.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 0.3483 0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3089 -2.5582 -0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1463 2.0811 1.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2986 2.0192 -0.9313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7021 2.0715 -3.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0079 -0.1016 1.4924 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7871 2.5613 -2.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0029 2.5881 -3.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0224 -4.0842 -0.9733 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5774 2.3676 0.9176 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2437 -1.1058 0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 0.1488 2.4956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4156 -1.8595 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -0.6049 2.5598 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3517 -1.6090 1.6209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.2605 1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9073 0.7738 -2.3622 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0098 0.2467 2.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9209 1.7190 1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 2.0265 -0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1015 2.0990 -4.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8808 -3.1818 -1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4306 0.7326 -0.0368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0488 -4.5271 -0.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3081 3.7016 1.8492 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7931 2.9724 -2.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4043 3.0158 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6017 -1.2718 -0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7707 0.9277 3.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6107 -2.6256 -0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8455 -0.4092 3.3403 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2668 -2.1920 1.6675 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 2 0 0 0 0 3 22 2 0 0 0 0 4 28 2 0 0 0 0 5 29 2 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 28 1 0 0 0 0 7 41 1 0 0 0 0 8 20 1 0 0 0 0 8 29 1 0 0 0 0 8 42 1 0 0 0 0 9 21 1 0 0 0 0 9 28 1 0 0 0 0 9 43 1 0 0 0 0 10 22 1 0 0 0 0 10 29 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 35 1 0 0 0 0 12 16 2 0 0 0 0 13 19 2 0 0 0 0 13 21 1 0 0 0 0 14 20 2 0 0 0 0 14 22 1 0 0 0 0 15 17 1 0 0 0 0 15 23 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 24 2 0 0 0 0 18 25 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 23 26 1 0 0 0 0 23 39 1 0 0 0 0 24 27 1 0 0 0 0 24 40 1 0 0 0 0 25 30 2 0 0 0 0 25 31 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 30 32 1 0 0 0 0 30 47 1 0 0 0 0 31 33 2 0 0 0 0 31 48 1 0 0 0 0 32 34 2 0 0 0 0 32 49 1 0 0 0 0 33 34 1 0 0 0 0 33 50 1 0 0 0 0 34 51 1 0 0 0 0 M END $$$$