PUBCHEM-ZINC00627567 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.0200 1.3460 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.0360 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -0.6450 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 0.1070 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.5230 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.1190 0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 2.3400 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 1.7860 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.4040 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -0.4510 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -1.8640 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -2.5840 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 -2.1420 -0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -4.0640 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -4.5750 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -5.9520 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -6.8210 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 -6.3210 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -4.9430 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 -4.3980 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 -5.0620 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 -6.2790 0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4890 -4.0790 0.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0820 -3.2170 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9680 -3.5630 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7620 -4.6140 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9400 -5.1340 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5080 -5.6650 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6730 -4.6420 1.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3400 -3.7900 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2730 -5.1360 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1940 -4.6570 3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 1.8230 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -0.6480 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -1.7300 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 3.2030 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 3.4230 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 2.4280 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 0.0270 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -2.4050 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -3.9240 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -6.3470 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -7.8960 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4490 -7.0390 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 -3.3730 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1240 -3.2310 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6040 -2.6820 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1070 -5.4490 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1290 -4.1780 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4520 -5.9270 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6680 -4.3260 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9490 -6.5990 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4090 -5.9310 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0960 -5.9120 3.3930 O 0 5 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 M CHG 1 54 -1 M END