IBS-ZINC04088976 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.9180 1.0660 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.2970 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.9550 1.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8530 -0.9020 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.1760 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -2.4540 1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6580 -2.9500 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -2.6670 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -3.0720 2.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -3.1460 2.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -3.4370 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -3.2140 1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -4.0810 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -3.8880 4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -4.4920 5.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -5.2860 5.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -5.4890 4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -4.8740 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -6.3340 4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -6.6240 6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -5.9870 6.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -6.0220 7.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 1.0020 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 1.4400 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 1.8020 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.1770 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.9500 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.0690 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.6740 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 0.8290 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -3.4140 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.2460 4.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -4.3370 6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -5.0160 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 -6.6900 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 -7.2250 6.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -2.4410 0.3870 O 0 5 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 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 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 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 37 -1 M END