IBS-ZINC01242793 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6960 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0630 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7330 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9510 -0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0120 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6680 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6990 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5090 2.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4040 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -1.4080 4.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.2920 5.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.2960 6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.9750 7.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.9740 8.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 2.1680 9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 3.3740 8.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 3.3850 7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 2.1940 6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 2.2040 5.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 3.4820 4.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 4.5460 9.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 4.4640 10.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.2910 2.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.6290 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.9050 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -4.3660 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -4.2130 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -4.6350 4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -5.2100 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -5.3620 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -4.9450 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -6.0830 0.7750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -5.7390 3.4940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.8840 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0770 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.6490 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -1.2330 7.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.0390 9.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 2.1670 10.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 4.3250 6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 4.0270 4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 4.0470 4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 3.3480 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 3.9180 11.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 3.9420 11.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 5.4680 11.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -3.9880 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -4.5280 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -3.7640 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -4.5150 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -5.0680 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 43 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 57 1 0 0 0 0 M END