IFLAB-ZINC05251509 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0900 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.0900 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 3.0230 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 3.4550 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 4.9800 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 5.3940 -1.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 6.7010 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 7.5350 -0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 7.1230 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 6.2890 -3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 8.4300 -2.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 8.8330 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 8.0350 -4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7420 8.4360 -5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 9.6300 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 10.4260 -5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 10.0330 -4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 11.7020 -6.0420 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7780 12.0510 -7.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 12.4040 -5.6460 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0040 0.0000 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 1.4700 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.4520 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.5260 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.0030 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 1.3920 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 3.4720 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 3.3520 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 3.1260 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 3.0060 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 5.3090 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 5.4290 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 4.7270 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 9.0920 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 7.1030 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 7.8170 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0420 9.9410 -6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 10.6570 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 1.5590 1.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 39 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END