B5T3MR -OEChem-04012113202D 21 21 0 1 0 0 0 0 0999 V2000 2.8090 1.5154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0064 -0.7926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4712 0.8547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.5155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1043 -1.4106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -1.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 0.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 -0.4324 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6180 -0.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 -0.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -1.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0577 0.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 0.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7226 -0.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5651 -1.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5147 -1.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 0.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9446 -1.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2721 1.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5961 -0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 20 1 0 0 0 0 2 10 1 0 0 0 0 2 21 1 0 0 0 0 3 10 2 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 9 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 M END $$$$