IBS-ZINC02444412 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.3850 2.0200 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 0.5130 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 0.1820 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.2530 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -1.7770 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -2.5350 -0.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2310 -2.2620 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -4.0720 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.5810 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -6.7570 2.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4010 -6.2280 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -6.5940 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -8.2090 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -8.6190 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -9.9480 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -10.8790 1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -10.4920 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -9.1630 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -12.5150 1.1640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -2.1430 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -1.6220 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4270 -1.2370 -2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -1.3620 -3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -1.8900 -3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -2.2800 -2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -0.9390 -4.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -0.9800 -6.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 2.5820 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 2.2860 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 2.3530 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 0.2440 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.3600 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.8620 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 0.8000 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.0200 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.1120 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.0120 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -2.1260 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -4.5570 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -4.3870 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -4.2540 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -4.2700 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -6.9510 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -7.1550 4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -5.5460 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -7.9120 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -10.2490 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -11.2180 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -8.8930 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -1.5000 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -0.8260 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -2.0100 -4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -2.6830 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -0.5820 -6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -0.3470 -6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -2.0090 -6.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -6.0800 1.2280 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8660 -6.4390 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -6.3880 0.4150 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 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 57 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 49 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 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 M CHG 1 57 1 M END