PUBCHEM-ZINC06361018 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.9460 1.2360 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.1680 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.1640 1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -0.9040 1.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.8480 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 0.0860 3.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -1.9160 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -1.9520 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -3.1580 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -3.7650 3.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -3.0680 2.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -3.3210 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.8720 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -1.3830 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -2.3560 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -2.8260 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -2.3260 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -1.3480 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.8360 -4.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0840 -3.6210 -4.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -2.4700 -4.1790 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9810 0.8990 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 1.4290 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 2.1510 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -1.6840 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -1.2070 5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -3.5230 5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -1.0160 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -2.7510 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -3.5890 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.9550 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END