OTAVA-ZINC02887971 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0610 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0050 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -0.7140 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0940 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.0560 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.6750 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -2.7860 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1690 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2480 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -6.3080 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -7.0760 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -8.4450 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -8.7680 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -7.2950 -0.3300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -10.0570 0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -11.0250 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -10.8150 2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -9.5650 2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -9.3640 4.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -11.9530 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -12.2150 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -11.5220 3.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -13.2180 4.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -13.4130 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -14.5920 5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -15.7950 4.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -16.9630 5.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -6.4980 3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 1.8810 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 1.8720 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.8430 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.1870 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.6470 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.1190 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -2.9780 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -2.1760 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -3.7330 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -4.6500 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -12.0370 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -11.7270 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -12.8360 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -13.6200 3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -12.5110 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 -14.6830 5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -14.4250 6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -17.1030 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -16.8450 6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -17.8330 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -6.4510 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -7.1310 4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -5.4950 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END