IFLAB-ZINC04088343 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.1520 2.0780 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 3.0500 -0.9320 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 1.9810 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 0.8440 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 0.1380 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -1.1170 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -1.6860 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -1.0400 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 0.1920 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 0.7830 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 2.3170 -1.2380 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -1.6360 0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8260 -0.8710 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 0.3410 0.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1540 -1.5040 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2700 -2.9010 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4860 -3.4940 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6580 -2.7150 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5420 -1.3180 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2940 -0.7160 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1580 -0.6380 0.7070 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.8370 -2.2030 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9380 -3.1090 0.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 2.6130 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 1.9210 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 1.1130 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -1.6320 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -2.6480 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 0.6960 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 -2.6000 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 -3.5110 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5590 -4.5710 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2100 0.3600 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8940 -2.4040 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 M END