IFLAB-ZINC04101138 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0580 1.5460 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 0.0160 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.4630 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.7930 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -2.5320 -0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -2.3640 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -3.8690 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -4.6250 -3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -6.3130 -3.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -5.8390 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -4.5470 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -6.7110 -0.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -8.0420 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -8.4760 -1.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -8.9670 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -10.3490 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -11.1510 0.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -10.6850 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -9.3590 2.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -8.4790 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -7.2800 1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -9.0450 3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -10.0430 4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -11.5150 3.3840 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -7.6140 3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 1.9150 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.9070 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.9060 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.3450 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.3530 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -2.0300 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -2.0220 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.2650 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -6.3630 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -10.7530 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 -9.9750 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -7.3220 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -7.5150 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -6.9680 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M END