PUBCHEM-ZINC03130939 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1360 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6310 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0100 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.7780 0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.2410 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -4.8330 -1.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5850 -4.4380 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -6.3330 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -6.9510 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -8.3280 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -9.0860 -0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -8.4690 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -7.0930 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -10.5600 -0.5710 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7790 -11.1050 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -11.2290 -0.8570 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1400 -4.4790 -2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1000 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.3550 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -3.7090 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -2.3420 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -4.5650 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -4.5830 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -6.3580 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -8.8100 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -9.0620 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -6.6100 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -4.7980 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 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 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END