IBS-ZINC02311352 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0100 1.2760 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 0.0310 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -0.4110 0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -1.1180 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -1.5550 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -1.3530 -2.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -2.2670 -2.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -2.6000 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -2.5850 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -3.2370 -3.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -2.1380 -1.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -1.4110 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -0.9270 0.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -0.2830 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 0.3300 2.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -0.2250 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -0.3750 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 0.8650 4.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 1.4550 3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 1.5880 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 1.3600 6.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 0.8170 7.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 2.6120 6.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 3.0340 8.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 4.2740 8.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 4.8060 7.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -2.4280 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.6010 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.0890 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 2.1050 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -0.7990 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.1860 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 0.4520 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -1.2060 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -0.7130 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -1.1400 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 2.4340 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 0.7850 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 1.9700 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 2.3490 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 2.4170 6.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 3.4250 5.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 3.2430 8.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 2.2110 8.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2330 -3.0060 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -3.0050 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -1.4860 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 4.6150 9.4870 O 0 5 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 21 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 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 48 -1 M END