BRAT36 -OEChem-04012119402D 48 51 0 0 0 0 0 0 0999 V2000 3.8000 -1.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -4.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 3.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 2.7882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 1.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 4.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 4.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -4.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -4.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 1.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1509 3.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1509 0.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5999 3.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5999 1.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8421 5.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 5.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 4.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5741 4.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 5.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9541 5.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -2.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -5.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -4.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -4.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 2 0 0 0 0 4 23 1 0 0 0 0 4 45 1 0 0 0 0 5 21 1 0 0 0 0 5 28 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 10 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 11 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 30 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 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 2 0 0 0 0 20 23 1 0 0 0 0 20 24 2 0 0 0 0 21 25 2 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 24 28 1 0 0 0 0 24 43 1 0 0 0 0 25 27 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M END $$$$