IBS-ZINC02238004 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -4.0490 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.6150 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -3.7780 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.3930 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -4.6610 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -5.9740 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -5.9290 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -6.7060 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -7.0220 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -6.7250 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -5.4720 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -4.4560 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -8.3420 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -8.6030 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -10.0230 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -11.0250 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -10.7010 0.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2200 -10.8100 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -9.2610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -11.6460 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -11.2130 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -12.9690 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -13.8190 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -15.2830 0.3490 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -2.2480 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -4.6850 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -1.7470 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -5.2740 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -8.5010 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -7.8870 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -10.2220 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -10.1220 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -10.9540 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -12.0350 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -9.0230 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -9.1560 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5640 -13.5570 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4550 -13.6780 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -15.4250 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -15.9220 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -15.5460 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END