IBS-ZINC04956068 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1660 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.4440 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8400 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.6170 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.9980 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.7480 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -4.1680 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -2.4580 -4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -1.7610 -5.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -0.3690 -4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.3650 -4.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -3.8980 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -4.2860 -5.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -5.7260 -6.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -6.0440 -7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -7.3650 -7.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -8.3680 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -8.0500 -6.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -6.7280 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2440 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -3.6940 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -4.4830 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -4.4590 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -4.6440 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -0.3360 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 0.1280 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 0.5000 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 1.3400 -3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -4.5360 -3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.0270 -4.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -3.6480 -6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -4.1570 -5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.2600 -7.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -7.6130 -8.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -9.4000 -7.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -8.8340 -5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -6.4800 -5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M END