IFLAB-ZINC04519435 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.0970 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -2.5560 -1.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -3.8730 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -4.6780 -0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.3410 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -3.5360 -1.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -5.6580 -1.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -6.1180 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -7.6440 -1.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7440 -7.9590 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -8.1160 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 -8.8120 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 -9.1360 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -8.7020 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6970 -7.8280 -2.4810 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -8.3610 -2.4180 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -8.0280 -3.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -8.1890 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -10.0980 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -10.7020 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -12.0640 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -12.8240 -2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -12.2200 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -10.8580 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -2.5280 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.4120 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -1.9120 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -6.3020 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -5.6870 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 -5.8020 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -9.1020 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1810 -9.6960 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9790 -8.8610 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -10.1080 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -12.5360 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -13.8880 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -12.8140 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -10.3880 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 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 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END