IBS-ZINC05072072 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 1.2080 0.2670 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -1.1730 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.6000 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -2.3480 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -2.8100 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -3.5150 -2.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -2.4180 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -1.6440 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.2340 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.4910 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -0.1760 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -0.5950 -4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -1.3410 -4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -1.7720 -5.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -4.0410 -5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -5.5320 -5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -5.9920 -7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -5.1990 -7.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.6780 -7.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8410 -3.4120 -8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.9080 -7.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -3.3540 -8.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -0.2910 -5.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 0.7410 -2.9720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.4070 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 0.9780 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.5230 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -1.8210 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -1.3170 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -2.6540 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.1450 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -1.4990 -6.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -1.2520 -6.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -3.7700 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -3.7290 -4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -5.7700 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -6.0770 -5.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -7.0600 -7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -5.8700 -7.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -5.4470 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -5.5330 -8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -1.8440 -7.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -2.9930 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -4.3530 -8.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -3.3560 -9.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -2.6680 -8.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 0.2470 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -3.2740 -6.0350 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4020 -3.5220 -5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 48 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END