0 mol 10 unq 0 iso 0 dist 6.47424 11.5624 9.59744 5.64721 7.30932 12.6064 numMergedOcc 0
1 mol 10 unq 0 iso 1 dist 9.59744 11.5624 6.47424 12.6064 7.30932 5.64721 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 5.78231 11.1714 9.41538 6.39966 6.89423 10.5977 numMergedOcc 0
3 mol 32 unq 0 iso 1 dist 9.41538 11.1714 5.78231 10.5977 6.89423 6.39966 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 8.6548 9.23344 6.02608 9.20656 7.68964 7.54186 numMergedOcc 0
5 mol 96 unq 0 iso 1 dist 6.02608 9.23344 8.6548 7.54186 7.68964 9.20656 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 8.71568 10.3536 5.81859 8.39835 7.68838 6.60434 numMergedOcc 0
7 mol 109 unq 0 iso 1 dist 5.81859 10.3536 8.71568 6.60434 7.68838 8.39835 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 6.98134 6.44723 8.55413 6.15779 7.70636 8.68996 numMergedOcc 0
9 mol 116 unq 0 iso 1 dist 8.55413 6.44723 6.98134 8.68996 7.70636 6.15779 numMergedOcc 0
10 mol 116 unq 1 iso 0 dist 6.98134 6.44723 8.55413 9.13854 6.82267 5.50076 numMergedOcc 0
11 mol 116 unq 1 iso 1 dist 8.55413 6.44723 6.98134 5.50076 6.82267 9.13854 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.03867 10.0132 5.94465 8.1844 8.16392 6.63536 numMergedOcc 0
13 mol 117 unq 0 iso 1 dist 5.94465 10.0132 8.03867 6.63536 8.16392 8.1844 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 7.53591 6.07339 8.34503 4.27597 7.43045 6.0848 numMergedOcc 0
15 mol 141 unq 0 iso 1 dist 8.34503 6.07339 7.53591 6.0848 7.43045 4.27597 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 4.55528 5.72474 6.88386 7.59741 7.26295 11.577 numMergedOcc 0
17 mol 194 unq 0 iso 1 dist 6.88386 5.72474 4.55528 11.577 7.26295 7.59741 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 4.42095 5.72474 4.63898 7.59741 7.31316 11.577 numMergedOcc 0
19 mol 194 unq 1 iso 1 dist 4.63898 5.72474 4.42095 11.577 7.31316 7.59741 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 4.42095 5.72474 4.63898 12.4055 8.9865 7.3101 numMergedOcc 0
21 mol 194 unq 2 iso 1 dist 4.63898 5.72474 4.42095 7.3101 8.9865 12.4055 numMergedOcc 0
22 mol 194 unq 3 iso 0 dist 4.42095 10.1601 9.53641 7.59741 7.31316 7.22039 numMergedOcc 0
23 mol 194 unq 3 iso 1 dist 9.53641 10.1601 4.42095 7.22039 7.31316 7.59741 numMergedOcc 0
24 mol 194 unq 4 iso 0 dist 4.42095 10.1601 9.53641 12.4055 8.9865 15.217 numMergedOcc 0
25 mol 194 unq 4 iso 1 dist 9.53641 10.1601 4.42095 15.217 8.9865 12.4055 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 4.63898 12.2071 9.53641 11.577 7.31316 7.22039 numMergedOcc 0
27 mol 194 unq 3 iso 1 dist 9.53641 12.2071 4.63898 7.22039 7.31316 11.577 numMergedOcc 0
28 mol 194 unq 4 iso 0 dist 4.63898 12.2071 9.53641 7.3101 8.9865 15.217 numMergedOcc 0
29 mol 194 unq 4 iso 1 dist 9.53641 12.2071 4.63898 15.217 8.9865 7.3101 numMergedOcc 0
30 mol 212 unq 0 iso 0 dist 8.13391 4.61536 9.10717 5.73348 6.47726 6.92241 numMergedOcc 0
31 mol 212 unq 0 iso 1 dist 9.10717 4.61536 8.13391 6.92241 6.47726 5.73348 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 9.89615 12.1772 5.77565 13.0142 8.90108 3.93072 numMergedOcc 0
33 mol 274 unq 0 iso 1 dist 5.77565 12.1772 9.89615 3.93072 8.90108 13.0142 numMergedOcc 0
34 mol 283 unq 0 iso 0 dist 9.82274 6.13301 7.17276 10.9203 9.33601 5.72409 numMergedOcc 0
35 mol 283 unq 0 iso 1 dist 7.17276 6.13301 9.82274 5.72409 9.33601 10.9203 numMergedOcc 0
36 mol 287 unq 0 iso 0 dist 9.03468 12.9333 6.05363 13.1162 9.2144 13.3584 numMergedOcc 0
37 mol 287 unq 0 iso 1 dist 6.05363 12.9333 9.03468 13.3584 9.2144 13.1162 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 9.03468 12.9333 6.05363 13.1162 9.2144 13.3584 numMergedOcc 0
39 mol 288 unq 0 iso 1 dist 6.05363 12.9333 9.03468 13.3584 9.2144 13.1162 numMergedOcc 0
40 mol 289 unq 0 iso 0 dist 9.03468 12.9333 6.05363 13.1162 9.2144 13.3584 numMergedOcc 0
41 mol 289 unq 0 iso 1 dist 6.05363 12.9333 9.03468 13.3584 9.2144 13.1162 numMergedOcc 0
