IBS-ZINC02273052 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 2.4260 1.4700 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.0310 1.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9540 -0.3500 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -0.7980 2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -2.2920 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -2.7050 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -1.8300 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -2.6380 0.2590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.2130 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -4.0820 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -5.2490 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -6.4020 1.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -6.4750 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -5.4170 0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -8.0680 0.7520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -9.1000 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -10.5480 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -11.3090 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -12.6370 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -13.2060 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -12.4390 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -11.1140 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -14.5110 1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -15.2060 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -15.7520 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -16.3650 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -5.1900 2.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.3260 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 1.6780 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 2.0150 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 1.7870 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -0.4580 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -0.6230 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -2.4890 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -2.8580 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -8.9610 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -8.8140 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -10.8660 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -13.2310 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -12.8800 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -10.5180 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -14.5210 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -16.2820 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -14.9260 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -16.4370 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -15.9760 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -16.8950 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -17.0500 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -4.3620 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -5.9770 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.1440 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 0.0630 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END