PUBCHEM-ZINC05140692 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 0 0 0 0 0 0999 V2000 -1.1980 0.6460 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 0.9030 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -0.4840 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.8740 4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 2.8890 1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 3.4190 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 4.9520 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 5.4340 -0.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 6.7710 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 7.7990 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 9.1530 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 9.5160 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 8.5350 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 7.1740 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 6.1780 -3.2420 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4690 4.9840 -2.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 6.5890 -4.3420 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7600 10.9360 -2.0990 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2910 11.7690 -1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 11.2150 -3.1550 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.4290 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 0.9270 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 0.9200 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 1.6300 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.9250 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -0.4850 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -1.2350 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -0.9220 5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.1900 5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 3.1240 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 3.3200 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 3.0520 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 3.0580 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 5.3320 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 5.3060 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 4.7540 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 7.5640 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 9.9020 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 8.8220 -3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 1.3710 1.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8750 1.1620 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -2.2250 5.2940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7550 -2.5010 6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -2.9560 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -2.2770 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 40 1 M CHG 1 42 1 M END