PUBCHEM-ZINC03871166 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -5.0020 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -4.8540 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -5.3560 -1.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9880 -4.8490 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -5.0890 -2.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5710 -4.9870 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 -6.3740 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -7.4370 -1.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4440 -7.7630 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -6.7710 -0.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -8.5820 -1.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -8.7730 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -9.8950 -0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -10.4940 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -9.6560 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -10.0190 -3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -11.1450 -3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -11.9630 -3.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 -11.6890 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -12.5510 -0.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -3.9300 -2.3270 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 -2.0600 -3.8020 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -5.4340 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -6.2990 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -6.5860 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -8.0930 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -11.4100 -4.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -12.3340 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 -13.3730 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -3.7200 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 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 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 M END