IFLAB-ZINC04032916 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 -0.6960 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7910 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1080 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7000 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0100 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.7180 -3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.1280 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -2.7620 -4.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7880 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.7580 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.0180 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 0.1280 -5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 0.8080 -6.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.0470 -7.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 0.6980 -6.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.7330 -8.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 1.9810 -9.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 2.6200 -10.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 3.0200 -11.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 2.7730 -10.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 2.1290 -9.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 3.7080 -12.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 4.1100 -13.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 4.7500 -14.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.9930 -14.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 4.5970 -14.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 3.9620 -13.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -4.2970 0.0180 C 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 0.0240 -0.1590 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6160 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 1.0900 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.6030 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.9700 -4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 0.7130 -4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -0.8600 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 1.0860 -7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 1.6710 -9.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 2.8120 -11.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 3.0840 -10.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 1.9330 -8.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 3.9190 -12.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 5.0610 -14.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 5.4940 -15.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 4.7900 -14.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 3.6580 -12.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -4.6750 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -4.6640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -4.6420 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END