B5AR3T -OEChem-04022101482D 48 52 0 1 0 0 0 0 0999 V2000 3.6180 2.5915 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5878 5.3026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 -2.4963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5350 -4.4963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 1.0037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 3.5425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 1.0037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9514 -3.6916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9514 -5.3010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.4963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 -5.4963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8968 4.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8968 4.3515 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2058 5.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3968 5.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 3.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 2.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0052 -3.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0052 -4.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 -3.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -1.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 -4.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -3.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 0.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -0.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -2.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -1.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -4.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 3.7349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5033 4.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2844 4.4485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7722 5.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5158 5.8395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8117 6.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9819 6.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2721 0.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1440 -3.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1440 -5.8904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 -3.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 -0.8063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -0.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -3.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0041 -2.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 -5.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 23 2 0 0 0 0 5 26 2 0 0 0 0 6 7 1 0 0 0 0 6 17 2 0 0 0 0 7 18 2 0 0 0 0 8 18 1 0 0 0 0 8 26 1 0 0 0 0 8 39 1 0 0 0 0 9 19 1 0 0 0 0 9 23 1 0 0 0 0 9 40 1 0 0 0 0 10 20 1 0 0 0 0 10 23 1 0 0 0 0 10 41 1 0 0 0 0 11 24 1 0 0 0 0 11 26 1 0 0 0 0 11 43 1 0 0 0 0 12 20 2 0 0 0 0 12 31 1 0 0 0 0 13 14 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 17 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 25 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 24 29 2 0 0 0 0 24 30 1 0 0 0 0 25 31 2 0 0 0 0 25 42 1 0 0 0 0 27 29 1 0 0 0 0 27 44 1 0 0 0 0 28 30 2 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M END $$$$