OTAVA-ZINC05414381 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.0160 1.5220 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.0080 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -0.5360 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.0660 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -2.5660 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -3.8990 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -4.6230 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -4.4920 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -5.9540 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -6.6330 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -7.9280 1.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -8.6960 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -8.0910 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -6.6180 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -6.0190 -2.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -9.0110 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -10.2990 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -10.4410 -0.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -11.4290 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -11.2310 -3.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -12.6880 -2.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -13.7720 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -13.6650 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -14.7370 -5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -15.9150 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -16.0250 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -14.9580 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -8.5860 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 1.8980 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8830 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.8740 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -0.3600 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.3690 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -0.1830 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -0.1740 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.4180 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.4270 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -4.1680 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -4.1590 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -6.0740 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -12.8430 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -12.7450 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -14.6540 -6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -16.7520 -5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -16.9470 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -15.0460 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -8.4170 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -9.3690 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -7.6650 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 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 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END