IFLAB-ZINC04167109 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8460 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.3930 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -3.7600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5980 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -4.0440 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -2.6760 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -6.0640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -6.5440 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -6.8700 -0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -8.3250 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -9.0010 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -10.4970 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -11.2730 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -12.9460 -0.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -12.4160 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -11.1200 0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -13.2990 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -14.6780 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -15.4980 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -14.9540 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -13.5820 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -12.7560 2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -15.7660 4.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -15.1400 5.3530 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 -3.6400 -1.7450 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -4.1840 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.6880 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.2480 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -6.4870 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -8.6300 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -8.6200 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -8.6960 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -8.7050 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -10.9340 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -15.1020 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -16.5660 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -13.1630 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -11.6900 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -14.4340 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -15.9000 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -14.6100 5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END