IFLAB-ZINC04328804 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 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 0.7180 -0.4980 -1.2570 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 -0.0080 -0.1400 2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -0.4840 3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -1.1010 3.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.1060 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 0.5110 4.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.4500 6.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -0.0790 7.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.5860 8.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4030 -0.3010 9.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -2.0510 8.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -2.3410 8.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -1.0520 9.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -0.0220 8.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -3.1530 8.3960 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -4.3750 8.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -2.5130 8.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -3.4250 6.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -4.4240 6.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -4.6390 4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -3.8520 4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.8500 4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -2.6420 6.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -4.0610 2.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -3.2130 2.0720 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 0.3530 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -0.9430 6.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.0060 7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -0.5270 7.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -3.2060 9.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -2.4940 7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -1.0760 10.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.9120 8.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -5.0370 6.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -5.4200 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -2.2350 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -1.8660 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -3.4860 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -3.3300 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -2.1750 2.1460 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 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 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 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 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 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END