IBS-ZINC02130017 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.8560 -0.2420 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.0900 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.8860 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.6210 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.3440 2.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1500 -0.7840 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.9510 3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.2480 4.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.1030 2.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 1.6020 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 0.8530 3.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 3.0900 3.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5310 3.5810 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 3.6140 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 3.3760 4.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 4.1480 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 4.6070 2.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 4.4200 4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 5.2060 4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 5.4300 4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 4.8790 6.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 4.0980 6.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 3.8610 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 3.0810 6.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 2.6890 7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 2.8600 5.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 2.1670 5.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -1.2810 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 0.0550 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 0.3940 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 0.9630 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.9380 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7780 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.5080 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.6950 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -0.1220 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 1.7020 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 3.1230 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 3.4020 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 4.6910 4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 5.6380 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 6.0400 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0050 5.0620 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 3.6720 7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.2740 3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.6170 4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 45 46 1 0 0 0 0 M END