PUBCHEM-ZINC05073004 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1030 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.9140 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.6670 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0210 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -4.1450 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -4.8000 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -4.7990 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -6.1500 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -6.8280 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -6.0770 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 -6.7170 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 -8.1070 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 -8.8560 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2410 -8.2270 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -10.3350 0.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5100 -10.9930 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6170 -10.8940 0.0240 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.8390 -8.7330 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0020 -7.9020 0.0620 C 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 -2.3300 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 0.0460 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -2.4100 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.5980 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -4.2180 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -6.7310 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 -4.9980 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4890 -6.1390 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -8.8100 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9900 -7.2770 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0080 -7.2690 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8950 -8.5270 0.0680 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 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 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END