IFLAB-ZINC02723211 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0120 1.5240 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0060 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.4770 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.8240 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.3480 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -3.7160 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.5660 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -4.0410 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -2.6730 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -5.9570 1.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -6.6620 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -7.9610 2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -8.0640 1.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.8670 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -6.5000 1.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -8.1700 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -8.1010 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -7.0290 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -9.2310 1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -9.1600 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -8.0140 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9290 -7.9470 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6290 -9.0190 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9570 -10.1610 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 -10.2320 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -11.4750 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6660 -6.7040 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.9020 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.8830 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.3830 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.3590 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -1.6870 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -4.1250 3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.7020 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.2640 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -6.2500 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -8.7820 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -8.7820 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -8.6120 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -10.0940 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -7.1770 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7030 -8.9630 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5060 -10.9960 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -12.1690 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 -11.9470 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -11.2080 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7350 -6.0140 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6690 -6.9720 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -6.2260 2.5070 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 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 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 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END