IFLAB-ZINC04275324 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -1.8100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.9130 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -4.3920 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -3.6540 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -4.2620 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -3.6750 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0060 -4.4480 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9040 -5.8470 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6470 -6.4470 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -5.6590 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -6.0940 0.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.1210 -6.6780 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0300 -7.8900 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3360 -6.0940 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4910 -6.9740 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -2.6000 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9800 -3.9820 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5610 -7.5230 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4760 -7.5990 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4600 -7.6080 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4030 -6.3770 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 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 33 1 0 0 0 0 15 16 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 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END