IFLAB-ZINC04941593 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0940 1.4930 -4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 2.3530 -4.2170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8850 2.5750 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 3.6600 -4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 3.3660 -6.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 4.5240 -7.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 1.6260 -4.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 0.7500 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 0.5640 -2.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 0.0090 -3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 0.1960 -4.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -0.8660 -2.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -1.4950 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3510 -1.7650 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4880 -2.3970 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 -2.5140 -1.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -1.9600 -1.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -1.8920 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -1.5780 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 -1.5130 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -1.7600 2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -2.0720 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -2.1450 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5170 -2.7770 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -2.7000 -5.4330 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -1.5460 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 2.0340 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.5620 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 1.2700 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 4.2330 -4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 4.2420 -4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 5.1240 -7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 4.2160 -8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 5.1150 -6.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 1.7750 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -1.0580 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 -1.3850 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7190 -1.2690 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -1.7080 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -2.2630 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -2.3930 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 -3.7860 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3370 -2.0590 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 -0.5160 -5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -1.7990 -5.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END