IBS-ZINC03984725 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.1480 1.7470 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 0.3850 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.4720 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.0900 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 1.4520 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 2.2930 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 1.6740 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 0.4420 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -0.5010 0.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -1.4890 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 2.9940 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 3.8470 1.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4390 4.0570 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 5.2440 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 5.3900 -0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 3.1360 2.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 2.5920 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 2.5920 3.9220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0430 1.2470 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 1.0080 4.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 0.2070 4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -1.0490 5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -2.0290 5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -1.7550 5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -0.5050 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 0.4710 4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 1.7680 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 2.1630 4.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 3.6990 5.3210 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 2.3960 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.0160 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5320 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.3580 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 0.1670 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 2.8070 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 3.5360 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 2.9510 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -1.2690 5.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -3.0010 5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -2.5150 5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4220 -0.3020 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 6.1040 1.9150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 42 -1 M END