OTAVA-ZINC00645747 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8200 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.3820 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -1.5290 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -2.0510 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -3.4180 4.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -4.2840 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -3.7620 2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -5.6340 3.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -6.1630 4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 -5.3520 4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 -5.9330 4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -7.2620 5.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -8.1180 4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -7.6230 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -8.4940 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -9.8530 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -10.3420 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -9.4840 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -10.7120 4.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 -5.0740 5.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 -5.6430 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 -4.8370 5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2680 -3.4600 5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 -2.8910 5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -3.6900 4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3510 -2.6690 5.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1720 -1.2630 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -0.4590 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -1.3870 5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -3.8190 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.4250 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -4.2800 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -8.1120 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -11.4040 4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -9.8740 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -11.0440 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -6.7120 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3170 -5.2750 5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 -1.8200 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -3.2460 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1120 -0.7490 5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8610 -1.0640 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 -0.9030 6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 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 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 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 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END