IBS-ZINC04729691 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 78 0 0 0 0 0 0 0 0999 V2000 0.3030 1.6990 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 0.1840 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.4670 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -0.1560 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 0.1470 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -2.0070 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.7160 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -4.1040 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -4.8350 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -4.1670 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -2.7610 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -4.9210 3.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -3.9600 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -5.7970 4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -5.7830 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -6.6120 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -6.1970 1.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -6.9230 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -8.4050 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -9.2720 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -11.5930 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -13.0650 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -13.5120 -0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -12.7530 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -11.2600 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -14.5690 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -15.3320 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -16.3870 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -16.6730 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -15.8860 -3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 2.0190 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 2.0220 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 2.2300 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -0.0510 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.2600 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 0.9210 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -0.5850 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -0.5580 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -0.0370 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.2670 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 1.2280 2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -2.2170 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -4.5860 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -2.2140 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -3.2690 4.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -4.5040 5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.3710 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -6.6920 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -6.1550 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.2300 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -6.4800 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -5.1260 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -5.9820 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -7.3090 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -7.2050 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -6.7050 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -6.6710 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -8.5850 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -8.6500 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -9.0620 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -9.1140 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -11.4460 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -11.2140 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -13.1720 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -13.6580 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -12.8830 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -13.0760 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -10.6760 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -11.0910 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -15.1490 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -16.9850 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -17.4870 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -16.0620 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -10.7400 -0.2100 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7570 -10.8610 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -14.8600 -2.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 74 1 0 0 0 0 21 22 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 21 74 1 0 0 0 0 22 23 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 25 74 1 0 0 0 0 26 27 1 0 0 0 0 26 76 2 0 0 0 0 27 28 2 0 0 0 0 27 70 1 0 0 0 0 28 29 1 0 0 0 0 28 71 1 0 0 0 0 29 30 2 0 0 0 0 29 72 1 0 0 0 0 30 73 1 0 0 0 0 30 76 1 0 0 0 0 74 75 1 0 0 0 0 M CHG 1 74 1 M END