IFLAB-ZINC04939514 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 1.3920 -1.4610 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -0.4150 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -0.1820 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.7920 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 0.0360 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -0.2900 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -1.4510 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -2.2810 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.9560 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -1.8510 0.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -1.1890 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -0.1040 1.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 -1.8950 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9650 -1.6220 2.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4580 -2.1290 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 -2.0780 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1960 -1.0690 2.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 0.2060 4.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9100 1.5360 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3340 1.8090 5.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2480 3.6000 7.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1010 4.8680 7.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4160 4.6070 6.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3860 4.1640 5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6060 2.8580 5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.1330 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -1.6180 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -2.4290 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 0.5310 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -1.0970 -3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.5750 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 0.1700 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 0.9490 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 0.3900 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -3.1940 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -2.6240 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -2.7210 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -1.5520 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -2.9760 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1870 0.2360 4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 -0.5960 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2700 2.3490 4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7890 1.5070 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 0.9870 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 1.9770 6.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 3.8070 7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6880 2.8070 7.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1990 5.2230 8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6420 5.6720 6.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4210 4.0090 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9570 4.9510 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0550 2.0630 5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5440 2.5540 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6710 -3.3050 2.4290 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.9620 -0.1220 2.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.1080 0.3230 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8140 0.1660 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1830 3.0620 5.9000 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.7320 3.7850 5.3220 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 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 55 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 58 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 54 -1 M CHG 1 55 1 M CHG 1 58 1 M END