IBS-ZINC02215149 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.5140 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -3.9380 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -4.3300 3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -5.8540 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -6.2290 5.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -6.4430 6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -6.7840 7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -6.7780 6.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -6.4180 5.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 -6.3360 4.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -6.5840 4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -6.4990 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -6.7520 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3120 -7.0970 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 -7.1900 6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 -6.9350 5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -7.0140 6.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -7.0780 8.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -8.2240 8.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -6.0890 9.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -6.4580 10.8670 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3900 -7.4780 11.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -6.3730 11.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -5.5060 11.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -4.1870 11.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -3.2150 12.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -6.3380 6.5260 N 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -4.3550 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -4.3290 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -3.9130 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -3.9390 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -6.2710 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -6.2450 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 -6.2330 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8220 -6.6860 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 -7.2940 5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 -7.4580 7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -7.0510 10.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -6.6540 12.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -5.3520 11.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -5.8400 12.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -5.5000 11.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -3.5010 13.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -3.1610 12.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -2.2400 12.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -6.0940 5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -6.5060 7.4180 H 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 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 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 31 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 M END