DB-1305
                    3D
 Structure written by MMmdl.
137145  0  0  1  0            999 V2000
   -8.4254    7.3787   -7.1920 F   0  0  0  0  0  0
    2.1691   11.0821  -11.2436 O   0  0  0  0  0  0
   -1.3182   11.5164  -11.9211 O   0  0  0  0  0  0
    1.8723    9.2073   -7.4797 O   0  0  0  0  0  0
    1.0399   11.5693  -13.1651 O   0  0  0  0  0  0
   -0.3638    9.0398   -7.7375 N   0  0  0  0  0  0
   -3.9253    8.7255   -8.0500 N   0  0  0  0  0  0
   -1.3295    7.0435   -4.0563 N   0  0  0  0  0  0
   -2.9678    7.2377   -5.8381 C   0  0  0  0  0  0
   -2.5168    6.4232   -4.6368 C   0  0  2  0  0  0
   -2.1173    7.9785   -6.6665 C   0  0  0  0  0  0
   -4.3662    7.2429   -6.1494 C   0  0  0  0  0  0
   -3.5885    6.2897   -3.5694 C   0  0  0  0  0  0
   -0.6187    8.1533   -6.5960 C   0  0  0  0  0  0
   -2.6311    8.6856   -7.7293 C   0  0  0  0  0  0
   -5.3445    6.5243   -5.3903 C   0  0  0  0  0  0
   -4.8352    5.7081   -4.2122 C   0  0  0  0  0  0
   -1.5471    9.3665   -8.4142 C   0  0  0  0  0  0
   -4.7977    8.0212   -7.2864 C   0  0  0  0  0  0
   -0.2907   10.7174   -9.9352 C   0  0  0  0  0  0
   -0.2110   11.6731  -11.1125 C   0  0  2  0  0  0
   -1.5592   10.1745   -9.4842 C   0  0  0  0  0  0
    0.8515   10.3910   -9.2852 C   0  0  0  0  0  0
    0.8554    9.5065   -8.1056 C   0  0  0  0  0  0
   -6.7031    6.5766   -5.7509 C   0  0  0  0  0  0
   -6.1698    8.0390   -7.5978 C   0  0  0  0  0  0
    2.1704   10.9211   -9.8204 C   0  0  0  0  0  0
   -0.2107   13.0894  -10.6186 C   0  0  0  0  0  0
   -7.1168    7.3326   -6.8511 C   0  0  0  0  0  0
    1.0557   11.4279  -11.9459 C   0  0  0  0  0  0
   -7.7309    5.8205   -4.9622 C   0  0  0  0  0  0
   -1.2830    8.2523   -3.4956 C   0  0  0  0  0  0
   -2.2637    8.9854   -3.4094 O   0  0  0  0  0  0
    0.0928    8.5842   -2.9987 C   0  0  1  0  0  0
    0.1540    9.3166   -1.6514 C   0  0  0  0  0  0
    1.3754    8.4519   -1.3112 C   0  0  2  0  0  0
    0.8545    7.4308   -2.3317 C   0  0  0  0  0  0
    1.4489    8.0085   -0.0065 O   0  0  0  0  0  0
    1.7120    8.9887    0.9286 C   0  0  0  0  0  0
    1.7632    8.3905    2.2595 N   0  0  0  0  0  0
    0.9710    8.7104    3.2832 C   0  0  0  0  0  0
    1.2898    7.9051    4.5079 C   0  0  0  0  0  0
    0.0937    9.5654    3.2055 O   0  0  0  0  0  0
    2.7084    7.5601    4.5079 N   0  0  0  0  0  0
    3.2042    6.3224    4.5079 C   0  0  0  0  0  0
    4.7042    6.3224    4.5079 C   0  0  1  0  0  0
    2.4954    5.3202    4.5079 O   0  0  0  0  0  0
    5.1909    5.1303    5.1961 N   0  0  0  0  0  0
    5.2042    6.3224    3.0937 C   0  0  0  0  0  0
    6.7042    6.3224    3.0937 C   0  0  0  0  0  0
    7.3991    7.5260    3.0937 C   0  0  0  0  0  0
    8.7890    7.5260    3.0937 C   0  0  0  0  0  0
    9.4839    6.3224    3.0937 C   0  0  0  0  0  0
    8.7890    5.1187    3.0937 C   0  0  0  0  0  0
    7.3991    5.1187    3.0937 C   0  0  0  0  0  0
    5.2713    4.9782    6.5183 C   0  0  0  0  0  0
    5.8151    3.6313    6.8928 C   0  0  0  0  0  0
    6.9759    3.7905    7.6220 O   0  0  0  0  0  0
    7.4502    2.5618    7.9499 C   0  0  0  0  0  0
    8.7137    2.7131    8.7442 C   0  0  0  0  0  0
    8.5388    2.1008   10.0580 N   0  0  0  0  0  0
    9.1457    2.4889   11.1800 C   0  0  0  0  0  0
    8.7427    1.6449   12.3527 C   0  0  0  0  0  0
    4.9338    5.8519    7.3117 O   0  0  0  0  0  0
    6.8956    1.5183    7.6238 O   0  0  0  0  0  0
    9.9353    3.4278   11.2205 O   0  0  0  0  0  0
    8.8066    2.4669   13.6058 C   0  0  0  0  0  0
    7.8729    3.6347   13.4859 C   0  0  0  0  0  0
    7.9369    4.4567   14.7390 C   0  0  0  0  0  0
    7.0032    5.6246   14.6191 C   0  0  0  0  0  0
    5.6399    5.1397   14.4242 N   0  0  0  0  0  0
    5.1096    4.9064   13.2261 C   0  0  0  0  0  0
    3.7815    4.4518   13.4817 C   0  0  0  0  0  0
    3.5961    4.4398   14.8086 C   0  0  0  0  0  0
    4.8021    4.8864   15.4266 C   0  0  0  0  0  0
    5.6666    5.0580   12.1394 O   0  0  0  0  0  0
    5.0394    5.0173   16.6269 O   0  0  0  0  0  0
   -0.1428   14.0267  -11.7877 C   0  0  0  0  0  0
   -1.4285   10.6037  -12.3145 H   0  0  0  0  0  0
   -0.5489    6.4091   -4.1481 H   0  0  0  0  0  0
   -2.2111    5.4373   -4.9891 H   0  0  0  0  0  0
   -3.8133    7.2681   -3.1425 H   0  0  0  0  0  0
   -3.2434    5.6555   -2.7524 H   0  0  0  0  0  0
   -0.3151    8.6211   -5.6587 H   0  0  0  0  0  0
   -0.1020    7.1997   -6.7134 H   0  0  0  0  0  0
   -5.6250    5.6318   -3.4634 H   0  0  0  0  0  0
   -4.6404    4.6916   -4.5574 H   0  0  0  0  0  0
   -2.4907   10.4068   -9.9827 H   0  0  0  0  0  0
   -6.4997    8.6183   -8.4443 H   0  0  0  0  0  0
    2.3885   11.8775   -9.3451 H   0  0  0  0  0  0
    2.9806   10.2397   -9.5583 H   0  0  0  0  0  0
    0.6538   13.2493   -9.9741 H   0  0  0  0  0  0
   -1.1241   13.2777  -10.0545 H   0  0  0  0  0  0
   -8.7169    5.9875   -5.3960 H   0  0  0  0  0  0
   -7.4981    4.7560   -4.9882 H   0  0  0  0  0  0
   -7.7248    6.1687   -3.9293 H   0  0  0  0  0  0
    0.6473    9.0792   -3.7999 H   0  0  0  0  0  0
   -0.7111    9.1376   -1.0079 H   0  0  0  0  0  0
    0.3362   10.3915   -1.7057 H   0  0  0  0  0  0
    2.3317    8.9055   -1.5839 H   0  0  0  0  0  0
    1.6154    6.9481   -2.9478 H   0  0  0  0  0  0
    0.2089    6.6612   -1.9013 H   0  0  0  0  0  0
    0.9235    9.7407    0.8984 H   0  0  0  0  0  0
    2.6700    9.4575    0.7039 H   0  0  0  0  0  0
    2.4956    7.6953    2.2795 H   0  0  0  0  0  0
    0.6939    6.9924    4.5079 H   0  0  0  0  0  0
    1.0582    8.4903    5.3979 H   0  0  0  0  0  0
    3.2536    8.4103    4.5079 H   0  0  0  0  0  0
    5.0676    7.2123    5.0217 H   0  0  0  0  0  0
    5.4568    4.4394    4.5091 H   0  0  0  0  0  0
    4.8409    7.2123    2.5799 H   0  0  0  0  0  0
    4.8409    5.4324    2.5799 H   0  0  0  0  0  0
    6.8581    8.4631    3.0937 H   0  0  0  0  0  0
    9.3300    8.4631    3.0937 H   0  0  0  0  0  0
   10.5659    6.3224    3.0937 H   0  0  0  0  0  0
    9.3300    4.1816    3.0937 H   0  0  0  0  0  0
    6.8581    4.1816    3.0937 H   0  0  0  0  0  0
    6.0294    3.0618    5.9885 H   0  0  0  0  0  0
    5.0793    3.0965    7.4933 H   0  0  0  0  0  0
    8.9427    3.7719    8.8643 H   0  0  0  0  0  0
    9.5332    2.2212    8.2203 H   0  0  0  0  0  0
    7.8840    1.3358    9.9798 H   0  0  0  0  0  0
    9.4211    0.7963   12.4399 H   0  0  0  0  0  0
    7.7249    1.2829   12.2072 H   0  0  0  0  0  0
    9.8244    2.8289   13.7514 H   0  0  0  0  0  0
    8.5138    1.8536   14.4580 H   0  0  0  0  0  0
    6.8552    3.2728   13.3404 H   0  0  0  0  0  0
    8.1658    4.2480   12.6338 H   0  0  0  0  0  0
    8.9547    4.8187   14.8846 H   0  0  0  0  0  0
    7.6440    3.8434   15.5912 H   0  0  0  0  0  0
    7.2961    6.2379   13.7669 H   0  0  0  0  0  0
    7.0497    6.2219   15.5297 H   0  0  0  0  0  0
    3.0727    4.1732   12.7154 H   0  0  0  0  0  0
    2.7050    4.1494   15.3462 H   0  0  0  0  0  0
   -0.1426   15.0559  -11.4288 H   0  0  0  0  0  0
    0.7707   13.8384  -12.3518 H   0  0  0  0  0  0
   -1.0073   13.8668  -12.4322 H   0  0  0  0  0  0
  1 29  1  0  0  0
  2 27  1  0  0  0
  2 30  1  0  0  0
  3 21  1  0  0  0
  3 79  1  0  0  0
  4 24  2  0  0  0
  5 30  2  0  0  0
  6 14  1  0  0  0
  6 18  1  0  0  0
  6 24  1  0  0  0
  7 15  2  0  0  0
  7 19  1  0  0  0
  8 10  1  0  0  0
  8 32  1  0  0  0
  8 80  1  0  0  0
  9 10  1  0  0  0
  9 11  2  0  0  0
  9 12  1  0  0  0
 10 13  1  0  0  0
 10 81  1  0  0  0
 11 14  1  0  0  0
 11 15  1  0  0  0
 12 16  2  0  0  0
 12 19  1  0  0  0
 13 17  1  0  0  0
 13 82  1  0  0  0
 13 83  1  0  0  0
 14 84  1  0  0  0
 14 85  1  0  0  0
 15 18  1  0  0  0
 16 17  1  0  0  0
 16 25  1  0  0  0
 17 86  1  0  0  0
 17 87  1  0  0  0
 18 22  2  0  0  0
 19 26  2  0  0  0
 20 21  1  0  0  0
 20 22  1  0  0  0
 20 23  2  0  0  0
 21 28  1  0  0  0
 21 30  1  0  0  0
 22 88  1  0  0  0
 23 24  1  0  0  0
 23 27  1  0  0  0
 25 29  2  0  0  0
 25 31  1  0  0  0
 26 29  1  0  0  0
 26 89  1  0  0  0
 27 90  1  0  0  0
 27 91  1  0  0  0
 28 78  1  0  0  0
 28 92  1  0  0  0
 28 93  1  0  0  0
 31 94  1  0  0  0
 31 95  1  0  0  0
 31 96  1  0  0  0
 32 33  2  0  0  0
 32 34  1  0  0  0
 34 37  1  0  0  0
 34 35  1  0  0  0
 34 97  1  0  0  0
 35 36  1  0  0  0
 35 98  1  0  0  0
 35 99  1  0  0  0
 36 37  1  0  0  0
 36 38  1  0  0  0
 36100  1  0  0  0
 37101  1  0  0  0
 37102  1  0  0  0
 38 39  1  0  0  0
 39 40  1  0  0  0
 39103  1  0  0  0
 39104  1  0  0  0
 40 41  1  0  0  0
 40105  1  0  0  0
 41 42  1  0  0  0
 41 43  2  0  0  0
 42 44  1  0  0  0
 42106  1  0  0  0
 42107  1  0  0  0
 44 45  1  0  0  0
 44108  1  0  0  0
 45 46  1  0  0  0
 45 47  2  0  0  0
 46 48  1  0  0  0
 46 49  1  0  0  0
 46109  1  0  0  0
 48 56  1  0  0  0
 48110  1  0  0  0
 49 50  1  0  0  0
 49111  1  0  0  0
 49112  1  0  0  0
 50 55  1  0  0  0
 50 51  2  0  0  0
 51 52  1  0  0  0
 51113  1  0  0  0
 52 53  2  0  0  0
 52114  1  0  0  0
 53 54  1  0  0  0
 53115  1  0  0  0
 54 55  2  0  0  0
 54116  1  0  0  0
 55117  1  0  0  0
 56 57  1  0  0  0
 56 64  2  0  0  0
 57 58  1  0  0  0
 57118  1  0  0  0
 57119  1  0  0  0
 58 59  1  0  0  0
 59 60  1  0  0  0
 59 65  2  0  0  0
 60 61  1  0  0  0
 60120  1  0  0  0
 60121  1  0  0  0
 61 62  1  0  0  0
 61122  1  0  0  0
 62 63  1  0  0  0
 62 66  2  0  0  0
 63 67  1  0  0  0
 63123  1  0  0  0
 63124  1  0  0  0
 67 68  1  0  0  0
 67125  1  0  0  0
 67126  1  0  0  0
 68 69  1  0  0  0
 68127  1  0  0  0
 68128  1  0  0  0
 69 70  1  0  0  0
 69129  1  0  0  0
 69130  1  0  0  0
 70 71  1  0  0  0
 70131  1  0  0  0
 70132  1  0  0  0
 71 75  1  0  0  0
 71 72  1  0  0  0
 72 73  1  0  0  0
 72 76  2  0  0  0
 73 74  2  0  0  0
 73133  1  0  0  0
 74 75  1  0  0  0
 74134  1  0  0  0
 75 77  2  0  0  0
 78135  1  0  0  0
 78136  1  0  0  0
 78137  1  0  0  0
M  END
> <s_m_entry_id>
41

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
