D0C1QZ -OEChem-10101305032D 21 20 0 0 0 0 0 0 0999 V2000 2.5369 -0.5855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0855 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4145 0.0000 C -1 0 0 0 0 0 0 0 0 0 0 0 4.6350 0.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -0.9515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.0855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -1.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -1.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 0.7245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 0.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 1.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 1.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 0.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -1.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -1.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 -0.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 0.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 0.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 M CHG 1 2 1 M ISO 1 4 11 M END $$$$