IBS-ZINC05164209 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 1.2520 -1.7510 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.3770 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.4050 0.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.2000 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -1.2350 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -3.3540 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -3.3600 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -4.4750 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -4.3790 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -3.2730 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 -5.3180 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -4.7040 -2.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1770 -4.8440 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0220 -5.2960 -2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1430 -4.8110 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1910 -5.6530 -2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1350 -5.5330 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7780 -6.6910 -3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4230 -6.4960 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -7.4410 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4520 -8.5440 -4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8080 -8.7040 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4970 -7.7790 -3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -9.3850 -5.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3300 -10.5240 -6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -3.2810 -2.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -0.9930 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -1.8540 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -2.7170 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.4190 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -1.2990 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -4.2850 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -2.3950 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -3.4790 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -4.4080 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -5.4650 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -5.3720 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -4.2310 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -3.3390 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -2.2950 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -5.4200 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -6.2930 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2840 -3.9390 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6990 -7.3260 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3730 -9.5460 -4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5540 -7.9120 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 -11.0840 -6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7110 -11.1840 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1280 -10.2280 -6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 -2.9120 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -4.3420 -1.4180 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0830 -3.4240 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 51 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END