CHEMDIV-ZINC04933587 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 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 3 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 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 -1.4330 -0.5340 0.0130 C 0 0 3 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 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.0490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.2420 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 0.5350 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 0.5660 2.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -0.6460 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 1.9720 1.7430 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7070 1.8670 2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 3.0310 2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 1.9920 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 1.4410 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 1.4550 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 2.0230 -2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 2.5750 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 2.5620 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 3.1910 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 2.4220 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 2.2370 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 2.2640 -6.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 2.0410 -4.1830 N 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 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 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 0.1720 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -0.1390 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 1.5380 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7690 -0.6880 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -0.6290 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 -1.5230 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1960 1.0000 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1610 1.0250 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4260 2.9950 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 4.2310 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 3.1460 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 2.9800 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 1.4460 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 1.9110 -4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 54 1 0 0 0 0 M END