PUBCHEM-ZINC06456160 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.7610 0.1380 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.3400 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -2.2340 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -3.5890 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -4.0520 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -3.1590 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.8030 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -3.6630 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -3.9210 -2.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -4.3840 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -4.6550 -4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -5.1250 -5.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -5.3300 -6.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -5.0550 -6.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -4.5810 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -5.8320 -7.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -5.6290 -8.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -6.1760 -10.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -6.9120 -10.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -5.8080 -10.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -4.9950 -10.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -4.4080 -11.3750 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.6370 -8.7930 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -6.2860 -12.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -5.3220 -13.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -4.2600 -13.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -3.3980 -14.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -3.6250 -14.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -4.6460 -14.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -5.4890 -13.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 0.5690 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 0.6180 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 0.2980 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -1.8720 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -4.2870 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -5.1120 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.1050 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -2.9110 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -4.5830 -2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -4.4970 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -5.3360 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -5.2120 -6.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -4.3650 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -6.3620 -7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -6.3570 -12.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -7.2690 -12.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -4.1070 -13.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -2.5600 -15.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -2.9580 -15.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -6.3160 -12.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 M END