IFLAB-ZINC05258826 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 1 0 0 0 0 0999 V2000 0.1690 1.2480 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 1.1150 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.1400 1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4030 3.4290 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 3.6780 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 3.2030 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 2.5030 0.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 3.5560 -1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 3.0520 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 2.8250 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 2.3250 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 2.0710 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 2.2970 -2.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 2.7780 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 3.7130 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 2.9820 1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.1620 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.5610 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.7030 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 1.5120 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.0290 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 1.3890 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 4.7680 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 3.3150 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 4.1600 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 3.0320 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 2.1360 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2960 1.6810 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 2.9550 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 1.6750 1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 5.0360 1.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 5.3570 1.6930 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 1 19 1 0 0 0 0 1 30 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 30 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 31 32 1 0 0 0 0 M END