IBS-ZINC02100980 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 59 0 0 1 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 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -2.8740 -1.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.9840 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -0.8370 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -0.1550 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -0.5970 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -1.7200 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -2.4380 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -3.5540 -3.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -3.8370 -2.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8520 -3.6550 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -2.6320 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8630 -2.3570 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 -2.4530 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1580 -2.2760 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9610 -2.4530 -5.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 -2.7900 -5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -2.9710 -4.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -2.7980 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -2.8970 -2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -3.1220 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8700 -2.0250 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -2.4420 0.8120 C 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 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -2.3640 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -3.8420 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -0.4860 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 0.7360 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -0.0460 -4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -2.0540 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1250 -2.0130 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7970 -2.3250 -5.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 -2.9160 -6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 -3.2350 -5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0690 -0.9540 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7950 -2.5730 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -2.0400 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 -3.5300 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -1.9190 0.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 -1.9560 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 53 54 1 0 0 0 0 M END