0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 12.5174 6.09254 7.21217 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.13983 5.63648 6.38364 9.42142 7.00835 8.39221 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 6.45858 4.05028 6.38364 10.2498 7.00835 8.39221 numMergedOcc 0
3 mol 14 unq 2 iso 0 dist 6.87018 5.45641 6.38364 13.5152 9.18933 8.73627 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 12.1682 5.45161 8.33883 numMergedOcc 0
5 mol 16 unq 1 iso 0 dist 6.36377 5.48395 6.31718 9.56648 5.35079 5.84479 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 7.7978 6.8958 7.17396 5.70814 6.34264 6.48625 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 9.55751 5.85228 7.17396 5.58384 6.34264 6.48625 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.22002 6.16737 6.65721 15.5461 10.7369 9.62468 numMergedOcc 0
9 mol 61 unq 1 iso 0 dist 9.22002 6.16737 6.65721 10.9902 5.4671 5.92705 numMergedOcc 0
10 mol 61 unq 2 iso 0 dist 7.52103 6.16737 6.72123 15.5461 11.5608 9.62468 numMergedOcc 0
11 mol 61 unq 3 iso 0 dist 7.52103 6.16737 6.72123 10.9902 10.1513 5.92705 numMergedOcc 0
12 mol 61 unq 4 iso 0 dist 8.46556 4.90701 6.72123 9.67403 11.5608 9.62468 numMergedOcc 0
13 mol 61 unq 5 iso 0 dist 8.46556 4.90701 6.72123 9.7314 10.1513 5.92705 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 5.58346 5.2774 6.89722 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 9.10386 5.44275 7.26679 numMergedOcc 0
16 mol 90 unq 0 iso 0 dist 7.75811 4.8042 5.83409 10.7828 5.49044 7.49054 numMergedOcc 0
17 mol 101 unq 0 iso 0 dist 5.22543 4.50603 6.57035 5.5199 5.16122 8.77773 numMergedOcc 0
18 mol 109 unq 0 iso 0 dist 8.73648 9.47324 7.34473 7.66832 5.5332 8.21889 numMergedOcc 0
19 mol 109 unq 1 iso 0 dist 8.73648 4.93112 8.58044 7.66832 5.5332 9.74643 numMergedOcc 0
20 mol 109 unq 2 iso 0 dist 8.73648 4.48038 9.97763 7.66832 5.5332 6.86702 numMergedOcc 0
21 mol 117 unq 0 iso 0 dist 6.90827 10.4485 7.90328 18.0633 14.3476 7.70533 numMergedOcc 0
22 mol 117 unq 1 iso 0 dist 8.90977 13.8755 7.90328 20.747 14.3476 7.70533 numMergedOcc 0
23 mol 126 unq 0 iso 0 dist 8.32241 4.84035 6.06638 12.7621 9.07346 9.06961 numMergedOcc 0
24 mol 131 unq 0 iso 0 dist 6.31125 5.59449 6.85062 14.524 14.257 8.97145 numMergedOcc 0
25 mol 131 unq 1 iso 0 dist 6.31125 5.59449 6.85062 10.9705 7.60371 6.5874 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 9.3894 4.84607 6.5107 6.85651 8.00493 8.84018 numMergedOcc 0
27 mol 133 unq 1 iso 0 dist 5.82404 4.64588 6.80239 6.23615 7.96098 6.11955 numMergedOcc 0
28 mol 152 unq 0 iso 0 dist 8.07256 10.4039 8.56324 16.9685 13.2491 8.89982 numMergedOcc 0
29 mol 180 unq 0 iso 0 dist 9.88732 6.54937 9.62337 5.43774 9.76368 8.44989 numMergedOcc 0
30 mol 180 unq 1 iso 0 dist 5.77949 6.91082 9.62337 8.31061 9.76368 8.44989 numMergedOcc 0
31 mol 180 unq 2 iso 0 dist 8.68403 10.1423 9.62337 9.91767 9.76368 8.44989 numMergedOcc 0
32 mol 180 unq 3 iso 0 dist 5.80441 9.82186 9.62337 13.9189 9.76368 8.44989 numMergedOcc 0
33 mol 205 unq 0 iso 0 dist 6.752 4.2475 7.45763 10.7582 10.6123 8.43584 numMergedOcc 0
34 mol 205 unq 1 iso 0 dist 5.4913 6.8901 7.45763 13.5379 10.6123 8.43584 numMergedOcc 0
35 mol 210 unq 0 iso 0 dist 8.62103 3.84723 6.18308 9.97171 5.82028 9.67457 numMergedOcc 0
36 mol 224 unq 0 iso 0 dist 8.39002 9.98893 8.95269 14.3452 14.2632 6.56437 numMergedOcc 0
37 mol 224 unq 1 iso 0 dist 8.39002 9.98893 8.95269 15.284 15.0038 6.23882 numMergedOcc 0
38 mol 224 unq 2 iso 0 dist 8.39002 9.98893 8.95269 15.7131 9.59595 9.53131 numMergedOcc 0
39 mol 224 unq 3 iso 0 dist 8.39002 9.98893 8.95269 13.2856 5.63485 9.34636 numMergedOcc 0
40 mol 224 unq 4 iso 0 dist 8.39002 5.72088 6.57273 13.2856 5.63485 9.79616 numMergedOcc 0
41 mol 224 unq 5 iso 0 dist 8.39002 6.51315 5.78342 12.9091 4.8786 9.29703 numMergedOcc 0
42 mol 224 unq 6 iso 0 dist 8.46129 5.72088 6.60589 13.2856 9.36962 9.79616 numMergedOcc 0
43 mol 224 unq 7 iso 0 dist 8.46129 6.51315 9.16166 12.9091 7.18448 9.29703 numMergedOcc 0
44 mol 224 unq 8 iso 0 dist 9.2053 6.51315 5.81334 12.9091 6.38066 9.29703 numMergedOcc 0
45 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 17.1493 11.9226 9.84492 numMergedOcc 0
46 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 9.36753 6.16697 5.89084 numMergedOcc 0
47 mol 234 unq 1 iso 0 dist 7.86368 6.94762 6.7625 9.36753 6.16697 8.47009 numMergedOcc 0
48 mol 236 unq 0 iso 0 dist 9.05929 4.32403 8.04248 12.3123 6.0258 9.10613 numMergedOcc 0
49 mol 236 unq 1 iso 0 dist 8.90987 16.8883 8.35971 16.9859 10.054 8.77254 numMergedOcc 0
50 mol 238 unq 0 iso 0 dist 6.24928 5.33567 6.57393 12.1043 10.8336 6.83152 numMergedOcc 0
51 mol 238 unq 1 iso 0 dist 9.13537 10.3859 6.57393 18.6974 13.477 9.75174 numMergedOcc 0
52 mol 238 unq 2 iso 0 dist 9.94315 12.521 5.72887 15.9247 6.62361 9.31417 numMergedOcc 0
53 mol 238 unq 3 iso 0 dist 9.94315 12.521 5.72887 15.6563 5.96552 5.56719 numMergedOcc 0
54 mol 238 unq 4 iso 0 dist 8.59074 9.18011 5.72887 14.2562 6.62361 9.31417 numMergedOcc 0
55 mol 238 unq 5 iso 0 dist 8.59074 9.18011 5.72887 13.2039 5.96552 5.56719 numMergedOcc 0
56 mol 238 unq 6 iso 0 dist 6.2365 4.7157 5.72887 9.91921 6.62361 9.31417 numMergedOcc 0
57 mol 238 unq 7 iso 0 dist 6.2365 4.7157 5.72887 8.20243 5.96552 5.56719 numMergedOcc 0
58 mol 241 unq 0 iso 0 dist 8.40773 6.72492 7.4631 12.3126 4.86437 9.72526 numMergedOcc 0
59 mol 241 unq 1 iso 0 dist 9.18476 9.87799 7.4631 8.15897 4.86437 9.72526 numMergedOcc 0
60 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 5.98006 5.71237 6.77279 numMergedOcc 0
61 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 5.98006 5.71237 9.58006 numMergedOcc 0
62 mol 259 unq 2 iso 0 dist 9.54857 15.3806 7.46176 17.6082 11.8501 9.58006 numMergedOcc 0
63 mol 264 unq 0 iso 0 dist 8.43858 8.55312 6.24356 13.3031 10.0289 6.75305 numMergedOcc 0
64 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 15.4711 10.7962 9.696 numMergedOcc 0
