CHEMDIV-ZINC00218569 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.0490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.2420 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 0.5350 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 0.5680 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 1.1200 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 2.4720 3.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 2.4590 4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 1.9470 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 3.0480 4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 4.2470 5.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 4.4800 6.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4910 5.5630 7.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4890 5.4900 8.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2660 4.3470 8.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0500 3.2690 7.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 3.3260 6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 2.4630 5.4390 O 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 0.1720 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -0.1370 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 1.2090 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 -0.4410 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4580 1.1580 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 0.4700 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 3.4690 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 1.8030 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 1.9220 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 2.6100 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 6.4550 7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6670 6.3270 8.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0460 4.3000 8.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6590 2.3820 7.4340 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 M END