CHEMDIV-ZINC06941785 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.5230 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0070 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0180 -0.3940 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.5420 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -1.3230 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -2.0260 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -2.6700 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -2.6080 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -1.9080 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.2550 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.5000 -1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -0.2620 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.6330 -3.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.4660 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.5990 -4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 1.8210 -3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -3.5660 1.1320 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 -3.5450 0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 -2.9430 2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -5.2470 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -6.1320 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -7.5290 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.7900 1.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -8.4870 2.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -9.8450 2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 -10.7170 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -10.9070 4.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 -11.7920 4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0910 -12.0910 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 -11.4410 2.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.8960 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8880 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8750 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 0.2840 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -1.1960 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 -2.0730 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -3.1100 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -1.8630 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 0.3400 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 0.1600 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 0.5610 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 2.5860 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 2.1850 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -5.2200 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -5.6530 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -6.1590 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -5.7260 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7740 -8.2780 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 -9.8180 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 -10.2510 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -10.4670 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -12.1590 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 -12.7450 3.4950 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 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 M END