IBS-ZINC02204342 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 71 0 0 1 0 0 0 0 0999 V2000 -1.3220 0.9920 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -0.4290 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -1.0930 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.4010 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.0530 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.3930 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.0830 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -4.7020 -0.8180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -4.9010 -2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -4.8720 0.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -5.7130 -0.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -5.9380 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -7.1860 -2.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4550 -7.0800 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -7.4270 -3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -9.9090 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -10.7800 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -10.3370 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -12.2380 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -8.2340 -5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -9.0100 -6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -8.7990 -7.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -8.5790 -7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -8.3090 -1.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -8.0350 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -5.6340 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -6.3190 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -6.2210 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -5.4280 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -4.7260 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -4.8200 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -3.8290 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.6770 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 1.1990 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 1.1890 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.5900 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.8960 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -2.8730 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -0.5670 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -6.1130 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -5.0580 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -7.7740 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -6.4950 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -10.3280 -4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -9.8710 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -10.7480 -4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -10.3970 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -10.9840 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -9.3140 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -12.5990 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -12.8870 -3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -12.3490 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -7.1590 -5.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -8.4860 -5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -10.0840 -6.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -7.7420 -8.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -9.3670 -8.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -9.1360 -7.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -8.7870 -6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -9.1160 -7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -7.5060 -7.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -6.9230 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -6.7550 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -5.3530 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -4.2430 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -2.8140 3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -3.7980 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -4.1920 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -8.4810 -4.2050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0700 -8.3150 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 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 38 1 0 0 0 0 7 39 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 26 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 69 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 69 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 69 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 29 30 2 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 69 70 1 0 0 0 0 M CHG 1 69 1 M END