IFLAB-ZINC04304465 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2220 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0410 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 2.3350 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 3.6090 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 1.4730 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 2.5980 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 3.8250 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 4.6960 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 4.0540 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 3.3880 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6420 1.8790 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 1.6620 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.1600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -2.7480 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.8560 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -4.3210 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9810 -4.6810 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -4.8750 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -6.3790 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -6.5870 -1.3040 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -6.9090 -2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -7.4100 -1.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -4.8430 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -0.4780 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 3.5440 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 4.3400 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 5.5900 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 4.9960 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 3.3150 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6480 4.8170 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0140 3.5060 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 3.8590 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 1.3410 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 1.4990 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 0.6630 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 1.6910 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.3870 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -4.7350 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -4.3520 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -6.9690 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -6.6700 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -4.2900 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -4.7880 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 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 42 1 0 0 0 0 16 43 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END