IFLAB-ZINC00211088 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.4220 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.0250 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -0.6750 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 0.0120 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4080 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.1330 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 3.6450 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 4.2100 -0.2170 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5700 -0.6930 -0.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -0.1730 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -2.0620 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -2.7110 -0.1060 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -2.7700 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.1460 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.7440 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -4.2460 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -4.8150 1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4170 -4.2880 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -6.3090 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -6.7240 2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -5.8670 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -4.6600 2.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 1.9650 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.5040 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 1.9520 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -4.6070 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -4.6190 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -6.8200 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -6.5340 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -7.7930 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -6.4550 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -6.3570 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -5.6240 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 4.2350 -0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 8 -1 M END