IBS-ZINC02254342 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 70 0 0 0 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6690 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.0370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5520 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.7020 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3300 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.4920 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.0950 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -1.0020 -5.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0440 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -6.5630 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -8.0140 -2.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -8.6920 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -8.0990 -3.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -10.1390 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -10.8460 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -12.2720 -4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -13.1660 -5.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -12.7680 -6.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -13.7190 -7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -13.3060 -8.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -11.9490 -8.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -11.0010 -7.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -11.3890 -6.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -10.4650 -5.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -12.3580 -3.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -11.1190 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -10.8710 -1.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -13.6140 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -14.0310 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -13.6860 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -14.2930 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -14.9720 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -14.8140 -1.9630 O 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 0.5290 -0.3650 0.8850 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 -0.2480 -2.2690 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -4.7050 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1070 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.7050 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -2.7230 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -0.3920 -5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -0.3750 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.4620 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -6.2750 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -6.5240 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -6.3330 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -6.0840 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -8.4860 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -14.7730 -7.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -14.0400 -9.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -11.6470 -9.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -9.9540 -8.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -9.9570 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -11.6090 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -13.4710 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -14.3890 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -13.0650 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -14.2240 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -15.5490 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 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 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 30 2 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 M END