IFLAB-ZINC04087172 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.5570 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 0.0360 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.5910 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.5220 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -1.1260 0.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.2400 2.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.5880 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.2330 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -0.8400 5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -1.5410 5.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -1.5160 3.5350 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -2.3040 5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -1.9180 7.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.8000 7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -2.8700 8.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 0.6140 4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 0.7650 4.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 1.2930 6.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8520 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.9680 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 2.0280 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -0.2190 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.3480 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -1.6820 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.2340 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 0.2800 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -3.3820 5.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -2.0660 5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -1.7300 9.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -2.9060 7.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 0.1700 7.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -0.8970 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 -2.8190 7.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -3.8860 8.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -2.5080 9.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.2850 6.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 1.8620 6.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -1.9620 7.4490 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9220 -1.0130 7.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 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 26 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 16 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 38 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END