IFLAB-ZINC04346957 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0220 -0.7200 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4290 0.7000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -1.9930 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6950 -1.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9470 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.4860 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -3.4200 -4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -4.7670 -4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.1730 -2.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.3230 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.1620 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 0.0080 3.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 0.5500 4.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 1.1830 5.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 1.5870 6.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 2.0700 4.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -0.1380 5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -0.8870 6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -1.9240 6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -2.2120 5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -1.4590 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -0.4200 4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6550 -3.2320 5.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 -3.4720 4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -1.4280 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -3.1010 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.4980 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.6930 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.8480 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.8050 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 0.6930 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -0.9600 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 0.5380 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.6620 7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -2.5090 7.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -1.6820 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 0.1690 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 -4.3100 4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1100 -2.5820 4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -3.7070 3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 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 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END