IBS-ZINC02350624 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 70 0 0 0 0 0 0 0 0999 V2000 0.7380 0.8230 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.5690 0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.9410 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -2.3230 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -2.8420 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -1.9760 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -0.5930 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -0.0770 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -2.5000 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -2.5160 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -2.1030 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -2.3290 3.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0270 -2.9420 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 -3.3900 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -3.1410 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6720 -3.5210 -0.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -3.1310 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -3.4610 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -4.6740 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 -5.0100 -4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -4.1420 -4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -2.9270 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -2.5900 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -4.5940 -6.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -3.7520 -7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -1.5080 3.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -1.1140 4.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -0.4970 4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -0.1380 6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 0.2870 8.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 0.7980 8.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 2.1480 8.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.2550 7.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 1.8220 6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 0.9470 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.2430 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 1.3620 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -3.0010 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.9210 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 0.0960 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 1.0010 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9350 -3.0920 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -5.3760 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -5.9600 -4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -2.2150 -4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -1.6280 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -2.8000 -7.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -3.5940 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -4.2590 -8.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -1.3630 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -0.3820 4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -1.9880 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -1.2060 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 0.3900 4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 0.6260 6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -1.0340 7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -0.7650 8.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 0.8960 8.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 0.7840 9.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.1670 8.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 3.3020 6.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.6570 6.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 2.4430 6.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 1.8530 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 0.3870 6.9460 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.2180 6.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 65 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END