CHEMDIV-ZINC04686050 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 0.0620 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -0.2400 -0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 0.5610 -2.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8700 1.5670 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 0.5890 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 1.0400 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 0.0910 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 0.1000 -4.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -0.3730 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -0.6420 -5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -0.4510 -7.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -1.3680 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -1.6300 -9.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -2.6580 -9.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -3.4310 -9.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -3.1820 -7.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -2.1520 -7.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -1.6670 -5.8660 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 -1.6440 0.1940 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -0.4080 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 1.2880 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 1.0210 -3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 2.0530 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -0.9190 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 0.4170 -5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -0.3840 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -1.3820 -3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -1.0310 -9.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -2.8620 -10.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -4.2340 -9.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -3.7880 -7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 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 40 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 19 1 0 0 0 0 18 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 M END