IFLAB-ZINC04134707 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.0930 1.4340 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 0.0050 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.6010 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.9840 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6040 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -1.8290 -3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.4470 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 0.1660 -2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.3090 -4.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 1.7280 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -4.0800 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -4.7540 -1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -4.6780 -3.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -6.0640 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -6.8870 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -8.2140 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -8.4520 -4.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -6.7220 -4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -6.1030 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -4.8920 -5.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -6.8530 -6.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -6.1610 -7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -9.2950 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -10.6250 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -11.6280 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -11.3190 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -10.0020 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -8.9880 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.8050 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7980 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.7870 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -2.5800 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -2.3060 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.2440 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 2.0250 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 2.0310 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 2.2110 -4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -4.1430 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -6.5110 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -6.8800 -8.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -5.6100 -8.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -5.4650 -7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -10.8680 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -12.6580 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -12.1080 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -9.7670 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -7.9610 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END