PUBCHEM-ZINC06491701 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.3090 1.4490 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0760 0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3550 0.2260 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.8190 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -0.2800 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -1.2760 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -0.7420 -1.8630 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9780 0.2310 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -0.5670 -3.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -1.7290 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -2.5920 -2.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -0.6030 0.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8200 -0.7020 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.0220 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -0.9680 1.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5160 -0.7730 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.1440 0.9210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4760 0.9370 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 0.8040 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -0.0230 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -1.2140 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -1.3380 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -2.5910 3.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 2.0860 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 1.9950 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.3430 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -1.8230 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -0.9380 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 0.6690 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -0.0830 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -2.2210 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -1.5100 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -1.4730 -3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -0.3360 -3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 0.2580 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -2.7900 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -2.2200 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.6220 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 1.2900 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -1.5480 -0.6200 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9980 -2.1220 0.5170 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3480 -2.9960 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -1.9380 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 0.5610 -2.7580 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4080 -0.3840 3.7080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 15 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 41 1 M CHG 1 44 -1 M CHG 1 45 -1 M END