IBS-ZINC02148019 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 0.0460 1.3860 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.1200 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.8590 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.2410 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.8820 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1430 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.7620 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.6430 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.9920 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -5.0940 1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -5.1360 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -4.7960 -1.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0150 -3.8990 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -5.9560 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -6.1270 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -6.9660 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -7.1240 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -6.4410 -3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -5.6020 -4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -5.4480 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -4.5460 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -4.6410 0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 -4.2160 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -4.1040 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -2.9680 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -2.8420 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 -3.8590 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9480 -3.7490 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8220 -4.7940 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3830 -5.9050 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1600 -6.8210 -0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1330 -5.9880 -0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2250 -5.0080 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9410 -5.1180 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3730 -2.5630 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7170 -2.6900 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1120 -1.5820 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1690 -0.3380 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8290 -0.2070 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4270 -1.3100 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5600 0.7520 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5960 2.0000 2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.7500 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.7840 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.7120 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.3580 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.8180 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6450 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1840 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -5.6500 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -6.8720 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -5.7410 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -7.5000 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -7.7790 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -6.5630 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -5.0690 -5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -4.7960 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -2.1820 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -1.9600 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8340 -4.7540 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -5.9940 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6730 -3.6570 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3780 -1.6800 4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8750 0.7610 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1580 -1.2060 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9240 2.7860 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6010 2.2360 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2930 1.9290 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 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 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 34 2 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 27 33 2 0 0 0 0 28 29 2 0 0 0 0 28 35 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 38 39 2 0 0 0 0 38 41 1 0 0 0 0 39 40 1 0 0 0 0 39 64 1 0 0 0 0 40 65 1 0 0 0 0 41 42 1 0 0 0 0 42 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 M END