PUBCHEM-ZINC06212045 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 -1.3740 -4.8060 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3640 -6.3420 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -6.8170 1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -6.3620 2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -5.1440 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -4.6810 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -5.4300 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -6.6350 4.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -7.1010 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -8.3900 3.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1500 -9.0390 4.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -8.8020 2.3010 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3040 -4.9380 6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -4.3690 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -3.4320 1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -4.2830 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 -4.7840 -1.2100 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 -2.3900 -6.7120 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -6.6970 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -3.7420 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -7.2150 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -5.3110 6.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -5.2980 6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -3.8480 6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -3.1930 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -4.6180 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -4.4920 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END