IBS-ZINC02194909 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.1310 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.3220 -3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -1.6770 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.4140 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -3.6640 -2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -3.4650 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -2.2010 -4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -1.4600 -5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -0.8710 -6.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -4.0000 -5.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -5.3170 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -5.6660 -7.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -5.3980 -7.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 -5.7230 -8.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -6.3080 -9.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -6.5450 -9.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -6.2270 -8.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -4.4130 -1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -5.7240 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -6.3270 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -7.1140 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -7.4500 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -6.8480 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -6.1740 1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -1.9250 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.9080 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -0.7820 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.2430 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 0.4500 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -3.5030 -6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -5.2970 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -6.0650 -5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 -4.9420 -6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -5.5260 -8.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 -6.5740 -10.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -7.0000 -9.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -4.0700 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -6.3790 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -5.6080 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -7.4290 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -8.0710 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -6.9020 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.4340 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.1460 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -4.1440 -3.5520 N 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 31 1 0 0 0 0 2 32 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 52 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 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 20 1 0 0 0 0 7 53 2 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 10 11 3 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END