PUBCHEM-ZINC02164822 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 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 7.3830 8.3510 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4730 9.7070 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 10.4800 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4160 11.8580 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 12.4670 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 11.6990 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 10.3210 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1340 12.3550 -0.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 10.2130 13.5700 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1460 11.6780 -0.0410 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 5.3520 10.0050 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 12.4600 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 13.5450 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 9.7210 -0.0260 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 23 1 M CHG 1 25 -1 M END