IBS-ZINC02444130 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -1.7410 0.9760 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -0.0370 0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.6420 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.2640 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.8700 3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -1.8740 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -2.2540 1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.6380 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -3.2250 1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -3.5580 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -2.5230 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.7790 5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -0.3190 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 0.4180 4.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 0.1380 6.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -0.7270 7.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -0.3370 8.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -2.3530 6.5870 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 1.5180 6.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 2.1190 7.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 1.4640 8.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 3.5750 7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 4.2110 8.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 5.5750 8.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 6.2600 8.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 5.6340 7.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 4.3370 6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 1.7780 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 1.3760 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 0.5470 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 0.5100 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.5730 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.9300 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -4.3460 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -3.9070 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -2.6770 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -3.5930 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 2.0400 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 3.6520 9.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 6.1000 9.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 7.3260 8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 3.8590 6.1440 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 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 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 42 1 0 0 0 0 M END