IBS-ZINC04046364 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.2560 1.2870 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.1490 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.9740 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -2.3100 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -2.8410 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.0380 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.6930 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.1610 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -0.6450 -3.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.0510 -4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.3100 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 1.7850 -6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.9140 -7.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 1.3420 -8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 0.4210 -9.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -1.0070 -9.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.8370 -10.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -1.3810 -8.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -0.4340 -7.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -0.9250 -5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 0.7160 -11.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 0.6510 -11.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -0.0640 -11.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 2.7930 -9.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 1.9540 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 1.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.5730 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.5760 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -2.9340 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -3.8790 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.4720 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 0.9150 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 0.6430 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 2.0350 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 2.8540 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.9880 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 0.0040 -11.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.6950 -11.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 3.0810 -8.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 3.0280 -10.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 3.4350 -8.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 1.3470 -12.7940 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 1 42 -1 M END