OTAVA-ZINC01961428 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 1.4870 1.7930 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 0.3130 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.4780 1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8250 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -2.6510 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -4.0200 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.5690 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -3.7410 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.3730 1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -5.9570 1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -6.7810 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -6.3240 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -8.2710 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -8.9410 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -9.3270 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -9.9240 -2.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -10.1930 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -9.8260 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -9.1740 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -8.8340 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -10.1740 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -10.7860 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -10.9780 -3.1840 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -11.2400 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -11.8720 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8370 -12.2940 -3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8580 -12.0910 -3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -11.4650 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 -11.0440 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 2.0780 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 2.3960 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.9580 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.0270 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.1470 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -2.2240 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -4.6630 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -4.1680 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -1.7300 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -6.3250 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -8.6190 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -8.5020 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -9.1320 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 -9.9610 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -12.0310 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0440 -12.7830 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8590 -12.4230 -3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -11.3090 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -10.5590 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 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 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END