B3G6EA -OEChem-04012117562D 20 21 0 0 0 0 0 0 0999 V2000 2.8660 -3.0202 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 1.5676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0202 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0981 2.5186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.5186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.5676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 3.0202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 3 9 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 11 13 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 19 1 0 0 0 0 M CHG 2 1 -1 4 1 M END $$$$