IBS-ZINC02330244 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7640 -0.1330 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -2.0260 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -2.7860 0.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.3530 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -1.2670 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -1.3080 4.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1210 2.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -3.7290 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.1950 3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -5.9750 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -7.3940 5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -8.2800 4.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -7.9200 3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -6.5060 3.0450 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 0.7830 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -3.7680 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -4.3810 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -4.1560 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.5430 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -5.2860 6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -5.9540 4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -7.7170 6.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -7.4040 6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -8.6230 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -7.9450 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -6.4930 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -6.2060 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -5.5740 4.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 39 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 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 M END