IBS-ZINC06764329 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.5940 1.8720 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 0.3430 -0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5590 0.0840 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.2870 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -1.1200 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.6980 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.4690 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -0.6430 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -0.0590 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -0.3800 2.9930 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -2.0770 4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -2.7790 4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -3.3610 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -3.2510 7.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -2.5590 7.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -1.9780 5.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -0.1760 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -0.5810 -1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.1050 -2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.5040 -3.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5940 -0.0590 -4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.0200 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 0.0050 -4.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 0.4890 -4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 2.2230 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 2.3100 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 2.2730 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -1.3290 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -2.3450 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 0.5640 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -2.8830 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 -3.8990 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -3.7020 7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -2.4680 8.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -1.4330 5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 0.2620 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.4440 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.4820 -3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -2.3200 -5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.1090 -6.1040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 40 -1 M END