IBS-ZINC04011372 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0900 1.7630 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.2710 -0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7680 0.1250 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -0.4060 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -1.9150 0.8640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7480 -2.1290 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -2.5560 0.6750 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8310 -2.4340 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -1.8840 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 0.2380 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -4.0610 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -2.4870 2.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -2.4250 2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -1.9640 1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -2.9520 3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -3.4450 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -4.8200 3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -5.3010 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -4.4170 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -3.0520 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -2.5690 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -1.9740 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -2.4660 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -1.5940 6.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.2190 6.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 0.2850 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -0.5850 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 2.2110 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 2.3040 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.9390 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 0.0390 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.2110 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -2.0090 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -2.2820 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 0.2470 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 1.2480 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -0.3510 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -4.5720 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -4.5080 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -4.2650 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -3.8390 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -5.5330 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 -6.3660 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -4.7910 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 -2.3610 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -1.5000 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -3.5370 6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -1.9880 7.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 0.4600 7.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 1.3580 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -0.1600 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.3950 -0.2110 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.2800 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 52 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 52 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 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 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END