IBS-ZINC02401455 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 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 -1.6060 0.1720 2.0080 H 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 -4.1050 -0.2430 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 0.4840 2.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 0.7170 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 0.6040 2.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9880 -0.1950 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 0.4960 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -0.9040 4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -1.0310 6.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 -2.7310 6.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 1.9380 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 2.7100 1.3950 O 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 -5.5590 1.2390 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1360 0.6740 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -1.6460 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -1.0810 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -3.4280 5.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -2.8630 6.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -2.9230 7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 2.2700 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4570 3.1360 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 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 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 42 43 1 0 0 0 0 M END