IFLAB-ZINC02457526 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.3210 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -1.8010 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -0.6840 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -0.2120 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -1.9660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -1.5120 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -1.9080 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 -3.3530 0.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -3.9060 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -3.4310 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3770 -4.1500 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0330 -3.6780 2.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4410 -5.6290 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3990 -6.2980 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4640 -7.7980 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4070 -8.4570 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9690 -7.7940 3.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.5670 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -2.4220 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -0.4360 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.4050 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 -1.9780 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -0.4280 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0280 -1.6760 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9770 -1.3620 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -4.9950 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -3.5520 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -3.7390 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -3.8710 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7990 -5.7880 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 -6.0630 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -6.1380 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3930 -5.8630 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8220 -7.9580 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 -8.2330 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6220 -9.7800 2.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2350 -10.1580 3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 48 49 1 0 0 0 0 M END