PUBCHEM-ZINC03873820 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 -3.2890 3.7410 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 2.4390 0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7960 2.2340 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 2.5730 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 2.3120 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 2.4380 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 2.8240 4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 3.0680 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 2.9320 2.2430 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0760 2.9610 5.6150 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7230 1.2880 -0.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7670 1.5430 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 0.0180 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 1.0500 -1.9030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4710 0.7860 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -0.0750 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 0.1710 -2.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -1.3540 -2.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -2.4480 -2.5890 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3910 -2.1690 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -3.7090 -2.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6250 -4.0330 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -3.4490 -3.8560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0170 -3.2330 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -4.7740 -4.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8890 -5.2130 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -5.6780 -3.9770 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4790 -6.3070 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -4.7630 -3.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -6.5060 -4.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -7.8560 -4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -8.6470 -5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -8.0700 -6.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -8.8490 -7.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -6.6960 -6.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -5.9180 -5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -4.7040 -5.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -4.5590 -6.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -2.3730 -4.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -2.7160 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 -2.4720 -0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 4.5890 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 3.7620 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 3.7990 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 2.0150 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1170 2.2410 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 3.3690 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 3.1040 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -0.2360 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 0.1880 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -0.8020 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -1.5510 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -8.3030 -4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -9.7180 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -6.2290 -7.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 -8.3560 -8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -3.9510 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -2.1670 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 2.7850 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1470 -3.2280 -1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 2.2730 -2.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 2.8520 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -3.3820 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 48 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 61 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 36 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 35 55 1 0 0 0 0 36 37 2 0 0 0 0 38 57 1 0 0 0 0 39 58 1 0 0 0 0 40 41 2 0 0 0 0 40 60 1 0 0 0 0 59 61 1 0 0 0 0 60 63 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 9 1 M CHG 1 10 -1 M END