IBS-ZINC02139788 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 0.0650 1.5690 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.1970 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.5150 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 0.1410 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 1.5200 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 2.2310 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -0.6310 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -1.1610 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -2.0970 -1.2180 P 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -3.3370 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -2.5770 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -3.2110 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7240 -3.6310 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -4.2040 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -4.6630 -6.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9710 -3.8800 -7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 -5.1550 -6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5610 -6.3220 -7.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -1.1120 -0.7670 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8570 2.1230 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.3200 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -1.5870 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 2.0440 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 3.2990 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 0.0070 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -1.4610 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -1.8250 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -0.3370 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -3.2670 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 -1.6770 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 -2.4970 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 -4.0810 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -4.3700 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5590 -2.7640 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8720 -3.4360 -4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -5.0390 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6770 -4.4120 -6.5640 O 0 5 0 0 0 0 0 0 0 0 0 0 8.3470 -5.8370 -6.5980 N 0 3 0 0 0 0 0 0 0 0 0 0 9.0540 -6.4870 -7.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 -5.6470 -7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 -6.3270 -5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 37 -1 M CHG 1 38 1 M END