PUBCHEM-ZINC06062439 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.6270 2.7030 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 2.7090 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 2.1720 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 1.6210 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.6350 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.1650 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 1.0340 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 0.9280 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 1.0760 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3780 -0.1890 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -1.5410 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2660 -1.4130 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7130 -2.3020 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 -3.5070 -1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7610 -4.3070 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 -5.4010 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7540 -6.3010 -2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8990 -6.1020 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9790 -5.0150 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9070 -4.1200 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0240 -7.0380 -2.2950 N 0 3 0 0 0 0 0 0 0 0 0 0 11.9160 -7.9850 -3.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0190 -6.8240 -1.5870 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2810 -2.2940 -0.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -3.2120 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 3.1180 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 3.1330 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 2.1890 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 2.1630 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 0.0350 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 1.6390 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 0.3280 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 1.9110 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 1.9060 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 0.4210 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -0.3070 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 0.5870 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5680 -1.6910 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -2.5600 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 -5.5530 -3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 -7.1390 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8620 -4.8480 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0010 -3.2920 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 0.2530 -0.6950 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4250 -0.6530 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 44 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 44 1 M END