IBS-ZINC06661716 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.9110 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -1.3690 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4190 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -1.0100 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.5480 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -0.6450 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -1.1160 -1.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -1.3590 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -1.2380 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -1.6560 -2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.8690 -3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -0.4230 -3.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.3100 -2.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -0.9850 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -0.5290 -5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -1.4390 -6.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -1.0230 -7.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 0.3090 -7.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 1.2200 -7.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 0.7980 -6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 0.7210 -8.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 2.1070 -9.2560 C 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 2.5540 -0.8730 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.6890 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.7770 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -1.0490 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -0.2250 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.0240 -5.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -0.3610 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -2.4760 -6.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -1.7340 -8.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 2.2580 -7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 1.5060 -5.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 2.3700 -9.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 2.7070 -8.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 2.3010 -10.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 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 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END