IBS-ZINC04817730 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 0.5360 1.6900 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.2780 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 0.1180 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -0.4040 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -1.8890 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -2.5720 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -3.9830 -2.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -4.5260 -3.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4390 -4.0850 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -6.0170 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -6.2780 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -4.9910 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -4.8690 -1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -7.3720 -1.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -6.9420 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -6.5340 -4.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -8.3110 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -9.2260 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -10.6300 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -11.5790 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -12.8940 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -13.2760 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -12.3440 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -11.0260 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -4.2440 -4.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -3.8720 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -3.6130 -6.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -3.7250 -7.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -4.0970 -6.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -4.3510 -5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.4440 -8.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 2.2050 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 1.6320 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 2.2410 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.3360 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.2370 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -0.1630 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 1.2040 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 0.1080 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -1.4760 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -0.2170 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -1.9890 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.3580 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -2.0820 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -2.4980 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -7.2360 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -8.6270 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -8.9240 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -11.2830 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -13.6280 -3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -14.3080 -2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -12.6500 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -10.3010 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -3.7840 -5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -3.3230 -7.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -4.1850 -7.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -4.6380 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -2.3880 -9.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -4.0500 -9.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -3.6910 -9.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.4640 -1.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 61 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 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 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 M END