IFLAB-ZINC04497455 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.0140 1.5520 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.1220 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.4970 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.8830 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.5100 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -1.7580 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -0.3770 -3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 0.2550 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -2.4460 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -2.6890 -5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -3.3760 -6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -3.6450 -6.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -3.6930 -7.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -4.3610 -8.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8530 -5.0420 -8.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -3.3280 -9.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -3.1430 -10.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -2.2240 -11.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -4.1470 -10.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -5.1020 -9.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -4.2660 -11.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -5.4010 -11.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -5.5160 -12.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -4.5010 -13.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -3.3690 -13.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -3.2470 -12.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -4.6160 -13.9450 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 1.9210 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.9070 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.9170 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.4700 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -3.5880 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.2070 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 1.3330 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -1.8150 -4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -3.3990 -4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -3.3200 -5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -1.7360 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -3.4780 -7.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -2.3860 -9.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -3.7180 -10.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -5.9900 -10.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -5.3770 -9.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -6.1920 -10.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -6.3990 -12.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -2.5790 -13.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -2.3620 -12.5550 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 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 M END