0 mol 1 unq 0 iso 0 dist 7.73435 5.71995 6.07818 7.27254 11.6921 10.2632 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 5.71995 7.73435 6.07818 7.27254 10.2632 11.6921 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.40479 9.38831 13.6675 8.24948 9.57743 4.47891 numMergedOcc 0
3 mol 24 unq 0 iso 1 dist 9.38831 9.40479 13.6675 8.24948 4.47891 9.57743 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 6.91393 8.40038 6.44494 5.07125 8.12964 11.6453 numMergedOcc 0
5 mol 56 unq 0 iso 1 dist 8.40038 6.91393 6.44494 5.07125 11.6453 8.12964 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 5.51624 7.8674 12.9364 7.8435 4.97727 13.8087 numMergedOcc 0
7 mol 93 unq 0 iso 1 dist 7.8674 5.51624 12.9364 7.8435 13.8087 4.97727 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 5.51624 7.8674 12.9364 5.99269 5.77343 9.96831 numMergedOcc 0
9 mol 93 unq 1 iso 1 dist 7.8674 5.51624 12.9364 5.99269 9.96831 5.77343 numMergedOcc 0
10 mol 93 unq 2 iso 0 dist 5.51624 7.8674 12.9364 5.71763 11.0802 5.33894 numMergedOcc 0
11 mol 93 unq 2 iso 1 dist 7.8674 5.51624 12.9364 5.71763 5.33894 11.0802 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.03035 7.6968 8.77578 9.6121 6.71103 12.4868 numMergedOcc 0
13 mol 119 unq 0 iso 1 dist 7.6968 8.03035 8.77578 9.6121 12.4868 6.71103 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 8.03035 7.6968 8.77578 9.57341 6.29394 9.64502 numMergedOcc 0
15 mol 119 unq 1 iso 1 dist 7.6968 8.03035 8.77578 9.57341 9.64502 6.29394 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.60521 6.39031 7.2676 7.1069 10.6183 4.71678 numMergedOcc 0
17 mol 152 unq 0 iso 1 dist 6.39031 8.60521 7.2676 7.1069 4.71678 10.6183 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.55358 7.60991 7.61858 8.57801 13.0608 11.868 numMergedOcc 0
19 mol 186 unq 0 iso 1 dist 7.60991 7.55358 7.61858 8.57801 11.868 13.0608 numMergedOcc 0
20 mol 193 unq 0 iso 0 dist 5.44396 6.22972 6.94466 7.39445 3.9625 9.42379 numMergedOcc 0
21 mol 193 unq 0 iso 1 dist 6.22972 5.44396 6.94466 7.39445 9.42379 3.9625 numMergedOcc 0
22 mol 194 unq 0 iso 0 dist 5.52678 9.81666 7.62717 5.53324 5.28603 11.0713 numMergedOcc 0
23 mol 194 unq 0 iso 1 dist 9.81666 5.52678 7.62717 5.53324 11.0713 5.28603 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 5.52678 9.81666 7.62717 6.72182 9.8803 15.9964 numMergedOcc 0
25 mol 194 unq 1 iso 1 dist 9.81666 5.52678 7.62717 6.72182 15.9964 9.8803 numMergedOcc 0
26 mol 237 unq 0 iso 0 dist 9.84466 6.16557 7.27576 8.7414 9.39277 5.1975 numMergedOcc 0
27 mol 237 unq 0 iso 1 dist 6.16557 9.84466 7.27576 8.7414 5.1975 9.39277 numMergedOcc 0
28 mol 237 unq 1 iso 0 dist 9.84466 5.4813 9.95884 8.7414 9.39277 5.69816 numMergedOcc 0
29 mol 237 unq 1 iso 1 dist 5.4813 9.84466 9.95884 8.7414 5.69816 9.39277 numMergedOcc 0
30 mol 237 unq 1 iso 0 dist 6.16557 5.4813 7.02925 8.7414 5.1975 5.69816 numMergedOcc 0
31 mol 237 unq 1 iso 1 dist 5.4813 6.16557 7.02925 8.7414 5.69816 5.1975 numMergedOcc 0
