IBS-ZINC06671795 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 0.0110 1.4430 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.0780 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -0.6920 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -0.1030 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.2720 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 2.0400 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -0.9320 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -1.0470 -1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1960 -0.0530 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 -1.5080 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 -2.4070 -0.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -2.0210 -2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -1.9380 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -1.0860 -4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.9800 -5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -1.7300 -6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -2.5780 -5.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -2.6750 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -3.5360 -3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.2300 -2.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -1.6260 -7.8120 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1090 -0.8540 -8.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.3170 -8.2760 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8950 2.0400 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -0.3890 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -1.7550 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 1.7520 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 3.1040 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -0.4770 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -1.9240 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -2.8270 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -0.5050 -4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -0.3150 -6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -3.1630 -6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -0.9080 -2.0150 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 31 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 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 3 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 35 -1 M END