IBS-ZINC03985029 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -1.8460 1.4200 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.3590 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 0.8930 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.4720 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 0.5780 1.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.1130 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 1.7730 -2.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 1.7060 -2.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3360 2.0490 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 2.6000 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 4.0410 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 4.9180 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 6.1310 -2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 6.9210 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 6.0620 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 4.7480 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 4.3820 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 5.3010 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 6.5980 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 6.9830 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 0.2840 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -0.5850 -1.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -0.0240 -2.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -1.4070 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -1.4810 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -1.3100 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -1.3780 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5130 -1.6160 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 -1.7880 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -1.7250 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 2.0760 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 1.8100 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.4200 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 0.8460 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 0.6230 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.3800 3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -1.0030 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 2.1120 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 2.3240 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 2.4690 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 4.6990 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 3.3740 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 5.0170 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 7.3130 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 7.9930 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 0.6710 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 -1.7420 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -2.0470 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -1.1230 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0990 -1.2440 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5280 -1.6690 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6430 -1.9740 -6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -1.8630 -5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 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 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END