IFLAB-ZINC04585277 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.4060 0.5540 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 0.7790 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 2.8080 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 3.6210 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 5.0700 2.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 5.9070 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 7.1770 0.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 7.6850 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 9.0170 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 9.3890 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 8.4530 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 7.1260 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 6.7650 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 5.2400 0.3240 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 5.5540 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 4.7410 3.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 7.0560 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 7.3010 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 8.7880 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 9.4030 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 9.1420 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 7.6540 3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -0.5090 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 0.7370 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 0.9100 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 1.0050 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -0.3010 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 1.2490 3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 3.0470 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 3.0140 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 3.3760 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 3.3410 3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 9.7460 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 10.4170 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 8.7570 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 6.4000 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 7.5620 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 6.7600 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 6.9060 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 8.9230 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 9.3150 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 8.9830 5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 10.4820 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 9.5240 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 9.6930 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 7.5200 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 7.1200 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 1.3100 1.4190 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9420 1.1200 1.4550 H 0 0 0 0 0 0 0 0 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 1 48 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 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 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END