IBS-ZINC06660433 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0260 0.6610 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -0.4650 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.9080 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.2200 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.9010 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.3420 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -0.7330 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 0.0490 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -0.4880 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 0.2110 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -0.4540 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0690 -1.6640 -0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8960 0.4860 -0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5160 1.8030 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2480 2.7750 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7680 1.9150 -0.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 0.1060 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9340 0.1250 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 0.2470 -2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3100 -0.0400 -1.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1020 -0.0300 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0540 -1.3690 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7970 -1.3190 -4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0730 -1.7020 -4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8980 -2.1380 -4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2320 -1.4340 -6.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0740 -1.6130 -6.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1100 -0.9070 -6.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9390 -0.6000 -7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2390 -0.8310 -5.8030 N 0 3 0 0 0 0 0 0 0 0 0 0 13.2900 -0.4710 -5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 1.0040 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -1.0000 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.7890 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 1.4390 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 2.2130 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -1.8150 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 1.1270 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -1.5720 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8330 0.8100 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3900 -0.9050 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7880 -0.1630 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7340 0.7780 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1300 0.2180 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4770 -2.1590 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0180 -1.6570 -3.5670 H 0 0 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 30 1 M END