PUBCHEM-ZINC04623535 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.6080 1.2800 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.5680 -1.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5070 2.6530 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 1.0570 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 1.5870 -2.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -0.1060 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.7460 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.8880 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -1.8630 -4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -0.7990 -4.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -0.6770 -4.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.0630 -5.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1980 -2.0720 -6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -2.6130 -5.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2040 -2.4610 -6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -3.9950 -5.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -2.8650 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -3.9890 -3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -4.8610 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -4.7720 -3.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -5.8750 -4.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -0.2390 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -0.8010 -0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 1.0540 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 1.6250 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 0.2010 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 1.7090 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.6990 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 0.1200 -5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -0.4490 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -4.2310 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -3.2420 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -2.3460 -3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -5.9190 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 -6.6040 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -3.0260 -4.9480 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2810 -3.9180 -4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -2.7850 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -3.1940 -5.4370 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 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 M CHG 1 36 1 M END