ZW6
  CCTOOLS-0814260951

 75 80  0  0  1  0  0  0  0  0999 V2000
    7.3400    0.8050   -0.9700 N   0  0  0  0  0
    8.5360    0.5860   -1.6720 C   0  0  0  0  0
    9.7170    0.7960   -1.0410 N   0  0  0  0  0
    9.7530    1.2020    0.2360 C   0  0  0  0  0
    8.5530    1.4240    0.9640 C   0  0  0  0  0
    7.3890    1.2150    0.3320 C   0  0  0  0  0
    8.4970    0.2090   -2.8510 O   0  0  0  0  0
   10.9430    1.3900    0.7980 N   0  0  0  0  0
    6.0440    0.5630   -1.6850 C   0  0  0  0  0
    5.4870   -0.8560   -1.4790 C   0  0  0  0  0
    5.1420   -1.4160   -2.7350 O   0  0  0  0  0
    4.2920   -0.6150   -0.5380 C   0  0  0  0  0
    3.8580    0.8160   -0.8840 C   0  0  0  0  0
    5.0830    1.4930   -1.2360 O   0  0  0  0  0
    3.2390   -1.5460   -0.7650 O   0  0  0  0  0
    3.1460    1.5830    0.2070 C   0  0  0  0  0
    1.7640    1.1600    0.2770 O   0  0  0  0  0
    0.5400    2.1250   -0.0120 P   0  0  0  0  0
    0.6960    3.5230    0.4490 O   0  0  0  0  0
    0.1830    1.9950   -1.4840 O   0  0  0  0  0
   -0.6750    1.4560    0.7680 O   0  0  0  0  0
   -0.7600    0.5900    2.1040 P   0  0  0  0  0
   -0.6130    1.4850    3.2720 O   0  0  0  0  0
    0.3510   -0.4460    1.9810 O   0  0  0  0  0
   -2.1590   -0.1520    2.0110 O   0  0  0  0  0
   -2.5220   -1.0380    0.9350 C   0  0  0  0  0
   -3.6250   -1.9890    1.3980 C   0  0  0  0  0
   -3.8930   -3.1470    0.4490 C   0  0  0  0  0
   -2.6820   -4.2630    0.1090 S   0  5  0  0  0
   -5.1020   -3.3270   -0.1280 C   0  0  0  0  0
   -5.3490   -4.5690   -1.2240 S   0  5  0  0  0
   -6.3120   -2.4470    0.1910 C   0  0  0  0  0
   -6.1100   -1.6050    1.4880 C   0  0  0  0  0
   -4.7590   -1.1220    1.5970 O   0  0  0  0  0
   -6.6510   -1.6170   -0.9660 N   0  0  0  0  0
   -7.2630   -0.3790   -0.8500 C   0  0  0  0  0
   -6.9860   -0.4420    1.5440 N   0  0  0  0  0
   -7.4400    0.1900    0.4270 C   0  0  0  0  0
   -8.0190    1.4030    0.6070 N   0  0  0  0  0
   -8.4550    2.0560   -0.4740 C   0  0  0  0  0
   -9.0390    3.2420   -0.3220 N   0  0  0  0  0
   -8.3300    1.5640   -1.7420 N   0  0  0  0  0
   -7.7310    0.3380   -2.0110 C   0  0  0  0  0
   -7.6510   -0.0590   -3.1690 O   0  0  0  0  0
   -3.2760   -5.2760   -1.8400 MO  0  0  0  0  0
   -2.9840   -3.8510   -2.6440 O   0  5  0  0  0
   -1.7240   -5.7540   -2.1870 O   0  5  0  0  0
   -4.0200   -6.2950   -3.7640 SE  0  5  0  0  0
    8.5730    1.7100    1.8620 H   0  0  0  0  0
    6.5850    1.3530    0.7950 H   0  0  0  0  0
   11.6740    1.2490    0.3350 H   0  0  0  0  0
   11.0070    1.6550    1.6320 H   0  0  0  0  0
    6.1720    0.7040   -2.6610 H   0  0  0  0  0
    6.1570   -1.4190   -1.0310 H   0  0  0  0  0
    4.9340   -2.2270   -2.6540 H   0  0  0  0  0
    4.6000   -0.6770    0.4040 H   0  0  0  0  0
    3.2640    0.7960   -1.6790 H   0  0  0  0  0
    2.6570   -1.4950   -0.1590 H   0  0  0  0  0
    3.1940    2.5540    0.0090 H   0  0  0  0  0
    3.5920    1.4230    1.0800 H   0  0  0  0  0
   -0.5000    2.5050   -1.7240 H   0  0  0  0  0
    0.3980   -0.9910    2.6780 H   0  0  0  0  0
   -1.7390   -1.5540    0.6480 H   0  0  0  0  0
   -2.8440   -0.5200    0.1650 H   0  0  0  0  0
   -3.3540   -2.3770    2.2720 H   0  0  0  0  0
   -9.1340    3.5870    0.4800 H   0  0  0  0  0
   -9.3320    3.6880   -1.0190 H   0  0  0  0  0
   -7.0790   -3.0500    0.3670 H   0  0  0  0  0
   -6.3090   -2.1730    2.2730 H   0  0  0  0  0
   -7.2400   -0.1320    2.3330 H   0  0  0  0  0
   -6.4690   -1.9040   -1.7670 H   0  0  0  0  0
   -8.6360    2.0380   -2.4180 H   0  0  0  0  0
   -1.6930   -6.6170   -2.2410 H   0  0  0  0  0
   -3.6470   -3.6280   -3.1540 H   0  0  0  0  0
   -5.5230   -6.3020   -3.7770 H   0  0  0  0  0
  1  6  1  0  0  0
  1  2  1  0  0  0
  1  9  1  0  0  0
  2  7  2  0  0  0
  2  3  1  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  4  8  1  0  0  0
  5  6  2  0  0  0
  5 49  1  0  0  0
  6 50  1  0  0  0
  8 51  1  0  0  0
  8 52  1  0  0  0
  9 10  1  0  0  0
  9 14  1  0  0  0
  9 53  1  0  0  0
 10 11  1  0  0  0
 10 12  1  0  0  0
 10 54  1  0  0  0
 11 55  1  0  0  0
 12 15  1  0  0  0
 12 13  1  0  0  0
 12 56  1  0  0  0
 13 16  1  0  0  0
 13 14  1  0  0  0
 13 57  1  0  0  0
 15 58  1  0  0  0
 16 17  1  0  0  0
 16 59  1  0  0  0
 16 60  1  0  0  0
 17 18  1  0  0  0
 18 19  2  0  0  0
 18 21  1  0  0  0
 18 20  1  0  0  0
 20 61  1  0  0  0
 21 22  1  0  0  0
 22 23  2  0  0  0
 22 24  1  0  0  0
 22 25  1  0  0  0
 24 62  1  0  0  0
 25 26  1  0  0  0
 26 27  1  0  0  0
 26 63  1  0  0  0
 26 64  1  0  0  0
 27 34  1  0  0  0
 27 28  1  0  0  0
 27 65  1  0  0  0
 28 29  1  0  0  0
 28 30  2  0  0  0
 30 31  1  0  0  0
 30 32  1  0  0  0
 32 35  1  0  0  0
 32 33  1  0  0  0
 32 68  1  0  0  0
 33 34  1  0  0  0
 33 37  1  0  0  0
 33 69  1  0  0  0
 35 36  1  0  0  0
 35 71  1  0  0  0
 36 43  1  0  0  0
 36 38  2  0  0  0
 37 38  1  0  0  0
 37 70  1  0  0  0
 38 39  1  0  0  0
 39 40  2  0  0  0
 40 42  1  0  0  0
 40 41  1  0  0  0
 41 66  1  0  0  0
 41 67  1  0  0  0
 42 43  1  0  0  0
 42 72  1  0  0  0
 43 44  2  0  0  0
 45 46  2  0  0  0
 45 29  1  0  0  0
 45 47  1  0  0  0
 45 31  1  0  0  0
 46 74  1  0  0  0
 47 73  1  0  0  0
 48 45  1  0  0  0
 48 75  1  0  0  0
M  CHG  1  29  -1
M  CHG  1  31  -1
M  CHG  1  46  -1
M  CHG  1  47  -1
M  CHG  1  48  -1
M  END
$$$$
