OTAVA-ZINC05034675 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9460 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -0.1280 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -0.5610 -3.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -1.7060 -3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -2.3580 -2.4380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -2.3170 -4.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 -1.7140 -5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 -0.6360 -5.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6220 -2.3630 -7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 -1.7400 -8.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 -2.3480 -9.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -3.5820 -9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -4.2050 -8.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 -3.6050 -7.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 -4.1970 -11.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -5.3850 -11.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -5.5780 -12.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -4.5940 -13.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 -3.7090 -12.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 0.8130 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -3.1770 -5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 -0.7820 -8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -1.8670 -10.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -5.1630 -8.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -4.0920 -6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -6.0510 -10.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END