PUBCHEM-ZINC06015118 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 0 0 0 0 0 0 0 0999 V2000 0.4560 0.2980 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -1.0470 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.5440 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -0.9600 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.6890 -1.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.6210 -2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -1.0260 -4.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -0.2010 -2.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -0.4920 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 0.4960 -5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 2.4980 -6.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 3.3050 -6.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 2.4970 -7.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 1.3900 -6.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 0.4810 -6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 0.5430 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 2.0160 -1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 2.6090 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 4.0550 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 4.6670 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 6.0570 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 6.8410 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 6.2240 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 4.8390 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 4.2150 -2.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 4.7790 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 2.8530 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 2.3420 -3.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 8.1940 -1.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 9.0040 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 6.7450 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 6.0030 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 0.6120 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 1.0820 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.2290 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -1.7730 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.8540 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -2.5270 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -1.6420 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -1.9130 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.1720 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -0.5730 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4650 -0.5770 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -1.4950 -4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -0.0310 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 1.2260 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 3.1000 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 2.1090 -7.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 4.1360 -7.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 3.7310 -5.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 0.8260 -7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 1.7640 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 0.0810 -7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 -0.3360 -5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 0.1710 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 0.3460 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 2.0300 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 4.0470 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 6.8010 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 10.0350 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 8.9870 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 8.7050 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 5.2920 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 5.4990 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 6.7090 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 1.2910 -5.6100 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7950 1.6810 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 66 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 66 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 15 66 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 66 67 1 0 0 0 0 M CHG 1 66 1 M END