IBS-ZINC02107203 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.1120 0.5330 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.9760 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -1.7060 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -1.4270 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -0.8200 2.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.5440 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -0.8380 4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -1.3650 5.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 0.3330 4.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 1.1060 4.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4070 1.3230 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.3600 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 0.8640 2.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 2.4310 3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 3.0290 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 4.3930 4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 5.5300 4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 6.6840 4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 6.7320 5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 5.6220 6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 4.4360 6.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 3.1840 6.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 2.9240 7.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 2.3490 5.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 0.8840 6.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9080 0.3640 6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 0.7300 7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.4180 7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.2780 8.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 0.4500 9.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -0.2390 9.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.0940 8.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 0.2730 10.5430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 0.7670 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 0.8540 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.0530 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -1.2100 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -1.4720 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -2.7810 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -1.3850 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.5130 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -1.1150 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -1.6540 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -2.5340 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 3.1190 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 2.2470 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 5.5030 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 7.5830 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 7.6670 6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 5.6720 7.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 2.0650 6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 1.8160 8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -0.8860 10.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -0.6270 8.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 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 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END