PUBCHEM-ZINC06505187 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3390 0.0090 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 1.3170 -0.3910 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -1.3040 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 0.7250 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 1.7730 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6670 3.0760 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 3.3810 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 4.7290 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 5.0470 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 6.4570 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 7.3750 -0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 7.0270 -0.7990 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9120 6.7660 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 5.8400 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 8.2100 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 9.0860 0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 6.8450 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 5.9930 0.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.9150 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -1.1160 -1.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8760 -1.4800 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.1220 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -1.7460 -1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.9630 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.7580 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 3.8650 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 2.5910 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 4.2700 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 5.4830 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 6.1540 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.8790 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.4670 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 0.5230 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 8.2890 -1.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 8.1420 0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.4340 -1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 0.1640 -1.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 0.8360 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -4.0410 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 8.3460 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 9.0670 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 34 38 1 0 0 0 0 35 42 1 0 0 0 0 36 41 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 6 1 M END