BR6DQ4 -OEChem-04012113383D 58 60 0 1 0 0 0 0 0999 V2000 5.6866 0.2937 2.5636 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2876 -0.4568 1.2832 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8017 -1.8318 2.1006 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8893 -1.7317 0.6331 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7978 -3.7852 -0.1545 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.7871 -0.8339 -1.7815 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.0296 -2.3830 -0.8892 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6807 1.1741 1.4129 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.6133 1.8564 3.1733 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.7928 3.2628 2.0074 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3601 0.9170 -0.1559 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5808 3.4273 -1.3106 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4548 -2.1980 -1.0769 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8337 -0.7325 -0.4556 N 0 0 3 0 0 0 0 0 0 0 0 0 3.6160 -0.4705 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4299 -2.1104 -0.7351 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0975 -0.3811 0.3738 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4752 0.2978 -1.3341 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -2.3935 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9798 -0.5939 1.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6961 1.3620 -0.8798 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8987 0.2606 -2.6626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0753 -2.1626 -0.8944 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9746 -2.8868 1.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3407 2.3890 -1.7542 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5432 1.2875 -3.5369 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3302 -2.4249 -0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7641 2.3517 -3.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2804 -3.1491 1.7071 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4328 -2.9180 0.9559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5218 3.1296 -0.5274 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7266 -2.4737 -0.4881 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3792 2.0929 -0.8958 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7753 3.8667 0.6294 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7435 2.5302 1.0496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 1.7931 -0.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8862 3.5670 1.4178 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8256 -2.1526 -1.4678 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 2.2104 1.8929 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2792 0.4469 1.2299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4651 -1.2795 1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1671 -2.8130 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4166 -2.3208 -1.8121 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 -1.1140 -0.3953 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 1.3875 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5158 -0.5549 -3.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0033 -1.7776 -1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 -3.0771 1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 1.2600 -4.5706 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1801 1.5683 0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4905 3.1490 -3.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3589 -3.5344 2.7195 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3691 -3.1468 1.4507 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2173 1.5159 -1.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1104 4.6749 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1481 0.9842 -0.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0752 4.1468 2.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7535 -2.7364 -2.3894 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 20 1 0 0 0 0 3 20 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 38 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 39 1 0 0 0 0 10 39 1 0 0 0 0 11 17 1 0 0 0 0 11 50 1 0 0 0 0 12 25 1 0 0 0 0 12 31 1 0 0 0 0 13 27 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 19 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 20 1 0 0 0 0 17 44 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 21 25 1 0 0 0 0 21 45 1 0 0 0 0 22 26 2 0 0 0 0 22 46 1 0 0 0 0 23 27 1 0 0 0 0 23 47 1 0 0 0 0 24 29 2 0 0 0 0 24 48 1 0 0 0 0 25 28 2 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 27 30 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 32 38 1 0 0 0 0 33 36 1 0 0 0 0 33 54 1 0 0 0 0 34 37 2 0 0 0 0 34 55 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 35 39 1 0 0 0 0 36 56 1 0 0 0 0 37 57 1 0 0 0 0 38 58 1 0 0 0 0 M END $$$$