IFLAB-ZINC05241342 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 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 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -0.3510 1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -0.3380 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.3850 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -3.0780 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -4.4540 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -5.1450 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -4.4520 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -3.0640 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -5.1850 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -4.5790 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -6.5260 -2.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -7.2140 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -8.5660 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -9.0300 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -8.0320 -6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -6.4870 -5.2250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -8.5660 -7.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -10.0740 -7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -10.3610 -5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -9.4440 -2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -10.1400 -1.7820 N 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -2.5420 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -4.9900 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -6.2200 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -2.5220 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -7.0100 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -8.0830 -8.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -8.4090 -7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -10.2740 -7.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -10.6480 -8.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -10.6870 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -11.1170 -5.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 3 0 0 0 0 M END