IBS-ZINC00494834 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.4830 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0160 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6360 0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.9730 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -2.9350 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -2.8070 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -3.9300 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -5.1860 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -5.3270 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -4.2060 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -4.0510 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.7750 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.7150 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.0260 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -2.6310 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.6830 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 0.0280 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -0.1340 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 0.5260 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 0.3540 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 0.9740 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 1.7650 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 1.9390 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 1.3300 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -3.8090 0.0100 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.8530 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.9300 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.7520 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -1.8320 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -6.0600 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -6.3090 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -0.7510 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -0.2630 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 0.8420 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 2.2480 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4070 2.5580 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 1.4700 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 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 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 32 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 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END