IBS-ZINC05050105 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.3450 0.9410 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.3810 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 2.7270 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 3.6010 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 4.9400 -0.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 6.1250 -0.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6930 6.1500 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 7.3410 -0.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4370 6.6950 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 5.2100 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 4.4280 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 7.2470 1.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 8.4570 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 8.6400 1.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 9.2970 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 9.6500 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 10.3930 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 10.7730 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 10.4220 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 9.7000 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 10.7120 -0.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 11.3810 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 6.0380 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 5.8470 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 5.8320 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 6.0200 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 6.2220 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 6.2050 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 6.4370 -1.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 6.9280 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -0.1330 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.2330 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 1.4910 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.6180 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.6620 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.5840 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 3.0140 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 2.8040 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 3.6890 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 3.1390 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 7.7290 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 9.3850 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 10.6800 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 11.3450 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 9.4270 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 10.7850 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 12.3780 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 11.5090 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 5.7350 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 5.6910 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 6.0070 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 6.3680 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 6.1380 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 7.2390 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 7.8040 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.2550 -0.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4220 1.0080 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 56 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END