PUBCHEM-ZINC06201229 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.4750 0.4640 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.7580 0.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2310 -1.6290 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.7930 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -2.1370 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -2.5070 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -1.9650 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -0.9410 -1.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4350 0.3930 -1.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1370 0.8990 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 0.0910 -3.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3700 -0.3460 -3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -0.8780 -3.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0250 -0.5160 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -2.2230 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -0.8880 -4.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 0.3660 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 0.7340 -5.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 1.2020 -4.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9900 1.6470 -4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 2.2720 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 4.1230 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 5.0970 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 4.9740 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 4.0140 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 6.9520 -5.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 8.0660 -6.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 8.3540 -5.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 9.3810 -5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 9.6460 -4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 10.1240 -3.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 9.5300 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.3110 -2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 1.7960 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -1.5260 -2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 1.3870 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 0.5580 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.3750 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.0220 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.6370 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -2.0800 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -2.9280 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -3.2120 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -2.9340 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -2.6630 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 2.8170 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 1.7720 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 3.5260 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 4.6940 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 5.8060 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 4.5690 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 4.4340 -6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 5.5930 -6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 4.5830 -4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 3.3550 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 6.4820 -6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 7.3560 -5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 8.9600 -6.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 7.7480 -7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 10.2880 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 9.0460 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 10.3990 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 8.7280 -3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.8470 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.7250 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.4800 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 3.2300 -4.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 5.8980 -4.9810 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4130 6.4550 -4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 67 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 67 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 68 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 68 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END