PUBCHEM-ZINC06627811 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.8580 0.9700 -2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -0.3260 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -0.3830 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -1.5980 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.7340 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -2.7070 -2.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -1.5090 -2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -4.1000 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6370 -3.9640 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -4.7160 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -5.0240 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -5.5910 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -5.8590 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -5.5570 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -4.9890 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -6.4100 1.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -6.6660 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 -7.2440 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 -6.4230 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -6.9600 2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1960 -8.3190 3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1650 -9.1420 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -8.6070 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -4.5490 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -5.8170 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -6.8660 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -6.5090 -0.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4860 -6.6590 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -7.2930 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -6.8040 -2.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 1.4510 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 0.8090 -3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 1.6500 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 0.5180 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -1.6420 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -1.5280 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -4.8280 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -5.8240 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -5.7450 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -4.7580 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 -5.7380 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -7.3850 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -5.3590 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9880 -6.3170 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0010 -8.7350 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -10.1990 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 -9.2580 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -4.1630 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.7760 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -6.0510 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -5.7400 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -7.8790 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -6.7850 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -5.0080 -1.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3570 -4.9180 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -8.5930 -1.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -8.9900 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 54 1 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 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 54 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 54 1 M END