IBS-ZINC02125478 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 3 0 0 0 0 0 0 0 0 0 0.8110 -0.4330 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.0600 2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.1100 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.6070 0.3450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1590 -1.7100 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -0.2930 -0.6450 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0920 0.4160 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 0.2240 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -0.6760 -2.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2380 -0.4180 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.5340 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -2.1180 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -3.0090 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.3580 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -4.7650 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -3.8210 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -4.1780 -1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -2.5210 -1.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -1.5910 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.8390 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.8240 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.8130 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.5060 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 0.1250 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.7970 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.9360 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.8300 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 0.8680 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 0.0900 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 1.2660 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 0.1340 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.5160 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -2.6720 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -5.0650 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -5.8010 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -2.0550 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -1.3370 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 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 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 2 1 M END