IFLAB-ZINC00142685 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 1.3960 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 4.1640 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 4.2480 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 5.6490 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 6.3060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 5.6860 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 6.8760 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 8.0480 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 7.6830 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1630 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1710 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -2.7630 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5190 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9400 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 3.7710 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 5.0500 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 5.1110 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 6.6960 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 7.0670 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 8.1420 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 8.9780 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 8.3070 -0.2660 H 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END