IFLAB-ZINC00971248 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 0 0 0 0 0 0999 V2000 0.6020 0.9570 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.3920 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -0.4140 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -0.8470 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -1.3490 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -1.6850 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -1.5430 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -1.0330 -1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -0.7090 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -0.1930 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -0.0030 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -0.3230 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -0.8260 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -0.0200 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 0.4040 2.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 -1.8930 -3.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -1.7050 -5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -1.3070 -5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -1.9830 -6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -1.7900 -7.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9780 -2.0520 -8.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1950 -2.5050 -7.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 -2.6990 -6.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 -2.4460 -5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5080 -2.8370 -8.9700 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.7130 -2.7360 -8.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2460 -2.0610 -10.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3730 -4.4230 -9.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0540 -5.4810 -8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9060 -6.3100 -9.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0240 -6.8230 -10.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4390 -5.6360 -11.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5750 -4.7980 -10.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.9740 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 1.1010 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 1.7570 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -1.1920 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.5360 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -1.4800 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -2.0750 -4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 0.3910 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 -0.1670 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -1.0590 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -2.2710 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -1.4360 -7.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 -1.9020 -9.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3390 -3.0530 -6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -2.6010 -4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3140 -6.1230 -8.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6950 -5.0320 -7.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3410 -7.1560 -9.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7030 -5.6880 -10.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2130 -7.4240 -10.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6220 -7.4340 -11.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8300 -6.0010 -12.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2500 -5.0200 -11.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2410 -3.8990 -11.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 -5.3830 -10.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END