IFLAB-ZINC04248450 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.0080 1.4880 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0190 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.7080 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.0570 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.7710 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -4.1140 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -4.2590 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -3.0460 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -2.1270 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -0.7180 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -5.5700 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -5.6050 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -6.8800 1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -7.1350 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -6.3080 3.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 -8.4180 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -9.3220 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -10.5300 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -10.8740 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1610 -10.0070 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -8.7670 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -7.9030 4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 -8.2680 5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1960 -9.4890 5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 -10.3470 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 1.8650 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8430 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.8460 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -0.1550 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -2.5770 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -4.9100 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.1990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -5.6720 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -6.3910 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -5.5020 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -4.7840 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -7.5390 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -9.0840 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 -11.2160 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -11.8220 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 -6.9540 4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 -7.6010 6.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8610 -9.7550 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -11.2910 4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END