PUBCHEM-ZINC06193190 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 73 0 0 0 0 0 0 0 0999 V2000 -2.9740 1.8660 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 0.5810 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 0.1750 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -0.5860 -3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -1.6790 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -2.4020 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -3.7680 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -4.4610 0.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -5.6890 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -6.4410 1.4780 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 -6.3260 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -5.7370 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 -6.2200 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -7.3740 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6910 -7.8190 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -7.1080 -3.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -5.9510 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2450 -5.5070 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3350 -7.5440 -4.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -6.7620 -5.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -7.6080 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -7.3740 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -7.4790 3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4850 -7.2470 5.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 -7.3440 5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1280 -7.1190 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1210 -6.7940 7.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -6.6980 7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -6.9220 5.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -6.8310 5.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -6.6070 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -7.0530 4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -6.9690 3.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6930 -6.6240 8.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9880 -7.2460 8.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3240 -7.1490 7.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 2.5580 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 2.3250 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 1.6290 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 0.8170 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 0.1210 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.0490 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 1.2340 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -0.1250 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -1.6240 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5530 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -1.5690 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -2.2600 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -1.8080 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -2.5380 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -4.3630 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -3.6320 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -4.0350 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -6.0350 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -4.6500 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9230 -7.9270 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2570 -8.7200 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -5.3960 -4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -4.6030 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -5.7540 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -6.7150 -5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -7.2200 -6.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -8.2580 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -8.0800 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -7.7290 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5940 -7.5930 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -6.4470 7.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -8.2900 9.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7150 -6.7060 9.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -0.3520 -1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 70 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 70 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 5 70 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 53 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 57 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 23 2 0 0 0 0 22 32 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 27 28 2 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 M END