IFLAB-ZINC04570131 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -4.1130 2.8750 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -4.2720 4.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.4160 2.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -5.0850 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -5.3920 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -6.1500 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -6.5950 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -6.2920 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -5.5350 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -6.9460 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -7.6220 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -8.2640 -3.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -7.3790 -1.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 -7.8080 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -7.8800 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -6.5480 0.6280 C 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 -1.0200 -0.3810 0.0100 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 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -1.9180 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -5.0380 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -5.2900 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -7.6840 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -6.1950 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -8.7900 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 -7.0860 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -8.6530 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 -8.1480 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -5.7800 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -6.6560 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 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 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M END