PUBCHEM-ZINC03894211 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2080 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4030 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4830 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 4.2290 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 5.7300 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 6.5100 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 7.9470 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 8.8340 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 8.4420 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 10.3120 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 12.5090 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 13.2040 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 12.2170 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 11.0080 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.1610 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7580 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -0.5090 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 1.9520 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 3.9580 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 3.9680 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 3.9770 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 5.9920 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 5.9830 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 6.2480 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 6.2570 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 8.2600 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 10.5740 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 10.5650 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 12.8410 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 12.7110 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 13.3800 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 14.1440 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 11.9080 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 12.6730 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 10.0790 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 11.1040 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 11.0610 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END