PUBCHEM-ZINC02164824 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1040 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 3.5300 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 4.1320 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 5.6590 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 6.2620 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 7.7880 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 8.3910 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 9.8170 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 10.5110 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 9.8340 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9480 10.5420 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9300 11.9240 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 12.6020 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 11.8980 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 14.0820 -0.0140 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7560 14.7020 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 14.6790 -0.0010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2240 -2.1610 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -2.7580 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.5070 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 3.8630 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 3.8540 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 3.7980 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 3.8080 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 5.9930 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 5.9840 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 5.9280 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 5.9370 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 8.1220 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 8.1130 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 8.0570 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 8.0660 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 8.7540 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8910 10.0150 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8580 12.4760 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 12.4280 -0.0140 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 24 1 M CHG 1 26 -1 M END