IBS-ZINC04313015 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 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 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1020 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.5410 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -1.9220 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.6660 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0220 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -4.0240 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -4.7250 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -2.6210 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -2.9760 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -3.7850 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 -4.8250 0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 -3.3030 2.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 -2.1570 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6530 -1.7970 3.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 -1.3780 2.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 -1.6930 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -0.9780 2.3740 O 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 -2.3330 1.1810 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0360 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -2.6000 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -4.4510 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -4.4600 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -5.7980 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -1.9620 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -3.5320 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -3.6080 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -3.8030 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 -0.5620 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 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 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 M END