PUBCHEM-ZINC06382104 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.1110 -1.0270 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -1.6050 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.8780 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -0.6580 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.0380 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 1.4220 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 1.8880 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 3.3840 1.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4180 3.9580 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 3.7380 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 3.8070 1.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 3.4340 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6810 3.9590 0.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 4.7180 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 4.6370 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 5.2340 -0.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 5.9720 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 6.1420 -1.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5770 5.5120 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 5.6200 -1.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 6.3080 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 7.0900 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1130 7.7550 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4910 7.6440 -3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0240 6.8750 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1670 6.2140 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5390 8.4610 -5.0720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -0.5110 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -1.8300 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -0.3170 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -2.1260 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -2.3060 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -0.2480 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -1.9210 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.9070 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 0.3890 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -1.2820 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -0.1390 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -0.7160 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 2.0510 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.5450 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 1.2820 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 1.6890 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 4.7910 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.5830 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 3.1300 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 2.7770 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 6.4960 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4690 5.0870 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1910 7.2000 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 8.3540 -4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1000 6.7820 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6070 5.6180 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -0.4880 1.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3080 0.3160 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 54 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 47 1 0 0 0 0 13 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 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END