OTAVA-ZINC05555535 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0270 1.5430 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0130 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.4920 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.4960 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -1.6790 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -2.2700 -1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -2.2590 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -1.5820 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -2.1290 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -3.3450 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -4.0210 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -3.4830 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -5.3440 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -5.0650 -3.6900 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -4.3730 -3.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -4.5150 -4.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -6.7570 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -6.7220 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 -5.6600 -6.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -7.8710 -6.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 -7.8350 -7.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -6.8450 -8.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3590 -6.8120 -9.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 -7.7630 -10.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7140 -8.7500 -9.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 -8.7920 -8.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 1.9250 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.9030 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8910 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.3340 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -0.1440 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.5820 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -0.1100 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -0.6330 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -1.6070 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4760 -3.7680 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -4.0090 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -5.9590 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -5.8560 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -7.3300 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -7.2270 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -8.7240 -5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -6.1010 -8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -6.0420 -10.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -7.7350 -11.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -9.4910 -9.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -9.5660 -7.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 M END