IBS-ZINC02107340 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.3420 1.2900 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.1650 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.7940 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -0.1180 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -0.7620 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -2.0940 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -2.8130 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -2.1320 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.8610 -0.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -2.3110 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -2.9880 -1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -0.8920 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -0.3800 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 0.2540 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 0.8500 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2650 0.6880 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 1.5840 -2.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 2.2560 -3.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3420 2.6830 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9710 1.2570 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0480 0.8330 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9610 -0.1080 -3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -0.6400 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -0.2350 -5.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 0.7020 -4.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 3.4310 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 3.3610 -4.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -4.2530 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -2.6340 0.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 1.8970 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 1.7260 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.4190 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 0.9210 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -0.2210 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -1.1940 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 0.3360 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 1.0500 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.4950 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 1.7290 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 1.2280 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7910 -0.4250 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5170 -1.3710 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -0.6490 -6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 1.0010 -5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -4.8610 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -4.6740 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -4.3510 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 -3.5640 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 4.3180 -4.1180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 49 -1 M END