IFLAB-ZINC02684706 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8570 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.9920 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.4330 -1.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0640 -7.0780 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -8.4370 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -9.1270 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -8.4040 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -7.0470 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -10.5850 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -11.1980 -0.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -11.2320 -0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -12.6740 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -13.1550 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -12.5570 1.2500 O 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 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.7380 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -4.7130 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -6.5360 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -8.9590 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -8.8990 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -6.4800 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -10.7430 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -12.8800 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -13.1960 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -14.2400 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -12.8700 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -12.8180 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 11 1 M END