PUBCHEM-ZINC06044361 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0590 -5.0490 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -4.9460 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -5.3000 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -5.7590 -2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -5.8660 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -5.5140 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -5.5060 0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -5.0560 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -4.9090 2.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 -5.9090 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -7.4020 1.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1900 -7.6110 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -7.7920 2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -7.8620 4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -8.2630 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -8.4150 3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -8.1220 2.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -8.1550 0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -4.5890 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -5.2200 -4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 -6.0340 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -6.2240 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.5800 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -5.1340 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -5.3400 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -5.7150 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -7.6520 4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4070 -8.4190 5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1370 -8.7170 3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -8.0180 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 9 1 M END