IBS-ZINC05053828 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.3470 1.7680 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 0.2450 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -0.3820 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -1.9060 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -2.5060 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -2.6640 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -4.0050 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -5.0660 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -6.3550 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -7.4860 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -8.6730 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -8.7680 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -7.6680 -3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -6.4480 -3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -5.3300 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -4.1500 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -3.1810 -2.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -9.8920 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -2.9130 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -3.4860 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -2.6620 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -3.1770 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -2.9390 3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.1910 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -1.6780 4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -1.9040 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -1.3390 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 2.2150 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 2.1270 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 2.0470 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.0340 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.1150 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -0.1030 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -0.0230 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.1840 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -2.2650 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -2.6040 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -1.8730 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -4.9640 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -7.4200 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -9.7150 -3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -7.7520 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -5.3950 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -9.9440 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -10.7860 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 -9.8260 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -3.7610 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -3.3370 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -2.0080 5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -1.0950 5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -2.0910 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -0.4610 3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -1.0550 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 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 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END