IFLAB-ZINC04059594 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.2650 2.0330 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 0.6620 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -0.1120 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 0.4770 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 1.8440 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 2.6210 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 2.5280 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 1.5950 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 0.2950 -0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -0.4080 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -0.4770 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -0.8960 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -1.6690 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3030 -1.9780 -0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 -1.5620 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -0.8240 0.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -2.1120 -2.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -0.5290 -2.8460 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5700 0.4990 -3.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 -1.2560 -3.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6270 2.6420 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 0.1980 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -1.1830 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 3.6920 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 2.7910 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 3.4350 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 2.0210 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 1.4630 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -0.6920 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.3060 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -1.8300 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -1.8830 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 -2.6500 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END