IFLAB-ZINC04248754 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7310 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4330 0.6660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0020 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7120 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9030 -2.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2280 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.6340 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -5.2060 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.8960 -2.3020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -7.8020 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -7.2840 -5.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -8.2740 -5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -9.4480 -5.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -9.1580 -3.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -10.1260 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -10.3900 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -11.4080 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -11.6520 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -10.8750 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -9.8550 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -9.6170 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -11.1120 -1.0570 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.3440 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.5780 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.0620 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.0380 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -8.1480 -7.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -10.4320 -5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -11.0570 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -9.7230 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -12.0140 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -12.4470 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -9.2490 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -8.8240 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END