IFLAB-ZINC02694993 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3680 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 1.2280 -0.7020 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.0380 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 3.8520 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 4.2860 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 4.2260 -0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 4.3340 1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 4.6120 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 5.0020 3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 4.3730 3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 4.5610 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -1.0850 -0.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.4480 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.0330 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -3.7800 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -4.7490 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.4560 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -6.1980 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -7.1150 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -8.3190 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -8.0920 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -6.5580 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8900 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 1.9940 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 3.7220 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 5.4360 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 4.5710 4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 6.0850 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 3.3170 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 4.9180 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 5.5730 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 3.8290 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -4.0140 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -6.4080 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -6.5810 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -7.4520 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -8.3700 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -9.2410 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -8.4260 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -8.6090 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -6.3100 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -6.0560 2.1080 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END