IFLAB-ZINC05258633 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 0.0080 1.4160 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0130 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.5880 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -2.1140 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -2.7300 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -4.8220 3.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8270 -4.2240 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -6.2300 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.1400 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -5.0560 3.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -7.2640 4.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -7.1790 4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -6.0560 5.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -5.9740 5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -7.0080 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 -8.1320 4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -8.2260 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -9.3870 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -10.3090 3.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -4.9040 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -4.4840 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.7940 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.7750 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.7690 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -0.2520 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.2770 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -2.4500 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -2.4250 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -2.3930 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -2.4180 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -6.8000 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -6.7280 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -8.1320 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -5.2460 5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -5.0980 6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -6.9350 5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -8.9350 4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -4.1940 2.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -4.5270 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -5.4450 3.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 -5.4760 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 38 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 3 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 M END