IBS-ZINC04863056 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.0050 1.3330 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.1520 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -0.9390 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -2.3290 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -2.9160 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -2.1620 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7650 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.0890 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -4.3490 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -4.2420 -0.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -5.0160 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -5.5150 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -6.6470 -2.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -5.2130 -3.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -3.9000 -4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -2.8330 -3.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -6.3100 -4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -6.7220 -5.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -8.6440 -6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -8.1370 -5.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -10.1760 -6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -8.2610 -7.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -8.6650 -6.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -7.0410 -8.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 1.5700 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.8470 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.7250 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.4660 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.9240 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.1760 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -3.7990 -5.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -5.9870 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -7.1580 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -6.7900 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -5.9890 -5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -8.3080 -7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -8.3770 -4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -7.0560 -5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -8.6030 -5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -10.5930 -6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -10.6140 -6.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -10.5190 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -9.1030 -7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -7.8500 -6.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -9.5080 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -8.9840 -7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -7.2600 -9.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -6.7670 -8.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -6.1680 -7.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -8.0990 -5.9370 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8680 -8.7430 -5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 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 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 19 50 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 22 50 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END