IFLAB-ZINC03055396 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.8010 2.1440 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 0.6540 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 0.2180 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.1170 0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -1.3320 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -1.7880 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -2.1020 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -1.5930 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -2.2990 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -1.8390 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -2.7120 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 -3.8730 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -3.9040 -0.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -3.3640 -1.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.3540 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -4.1310 0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -5.7110 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -6.7630 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -8.0270 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -8.2530 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -7.2150 -2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -5.9470 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 2.7180 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 2.4540 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 2.3220 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.4750 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.3970 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.8430 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 0.7920 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 0.2460 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -0.6490 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -0.8700 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5700 -2.4800 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0070 -4.6700 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -3.5250 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -6.5880 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -8.8420 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -9.2450 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 -7.3980 -3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -5.1380 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END