IBS-ZINC03999894 MOE2007 3D Structure written by MMmdl. 58 59 0 0 1 0 0 0 0 0999 V2000 4.1390 14.1150 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 13.4360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 13.9460 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 11.9000 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 11.2790 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 11.2150 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 10.6470 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 10.1290 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 10.2010 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 10.7670 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 9.5060 0.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1370 9.3850 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 10.4540 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 8.1050 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 7.1870 0.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 5.8440 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 5.1300 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 3.7480 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 3.0460 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.7490 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 5.1300 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 1.5530 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 0.7330 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -0.7360 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.8400 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 13.8350 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 15.2050 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 13.8440 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 13.7240 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 13.5040 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 15.0340 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 13.6950 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 11.6060 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 11.4580 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 11.6110 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 10.6250 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 9.8240 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 10.8130 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 10.6940 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 11.4030 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 10.0140 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 7.5280 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 5.6180 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 3.2170 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 3.2240 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 5.6460 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.3430 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 1.2290 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 1.1010 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -1.1680 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.8390 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -1.3300 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 0.2130 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.8680 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 0.5160 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 7.0200 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 7.9100 2.6510 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3740 8.6540 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 57 2 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END