0 mol 0 unq 0 iso 0 dist 9.89568 4.80868 6.8892 9.8404 9.16606 7.16694 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 9.64098 8.89856 9.11704 12.3497 9.20106 5.88082 numMergedOcc 0
2 mol 13 unq 1 iso 0 dist 9.64098 8.89856 9.11704 4.32164 7.76514 7.10396 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.54999 6.81531 8.84944 6.66552 7.67459 11.3412 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.54999 10.5856 7.21995 6.66552 7.67459 5.88097 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.25196 6.39129 8.16246 5.05748 6.29755 10.4221 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 8.88159 6.39129 9.48823 5.05748 7.4038 10.4221 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 9.43192 9.5944 7.15248 5.49536 9.8048 12.8718 numMergedOcc 0
8 mol 67 unq 1 iso 0 dist 9.43192 6.26086 8.43162 5.49536 9.8048 9.08666 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.28357 9.04086 8.7142 7.17313 5.37449 8.23824 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 7.63813 8.65163 5.73235 4.96793 9.26231 10.2556 numMergedOcc 0
11 mol 76 unq 2 iso 0 dist 7.63813 11.1941 7.48127 4.96793 9.26231 8.90561 numMergedOcc 0
12 mol 83 unq 0 iso 0 dist 9.90769 15.5212 7.2118 7.97948 7.9309 9.9201 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 9.69413 7.89197 9.06641 5.22926 7.94379 6.3566 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 9.42064 9.45543 6.79959 11.3296 8.88401 10.503 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 8.45451 12.0208 7.18976 5.20968 8.03603 9.2094 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 6.25968 10.9848 9.88178 5.50185 8.15734 15.6097 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 6.25968 10.9848 9.88178 5.58691 6.00896 5.57607 numMergedOcc 0
18 mol 140 unq 0 iso 0 dist 9.16949 11.7651 9.13339 6.09043 6.55217 5.90456 numMergedOcc 0
19 mol 140 unq 1 iso 0 dist 9.16949 5.14081 7.60956 6.09043 6.55217 5.00766 numMergedOcc 0
20 mol 140 unq 2 iso 0 dist 8.65294 5.14081 9.9171 6.09043 7.21686 5.00766 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 6.33118 8.85571 9.96635 9.51094 8.95432 17.5374 numMergedOcc 0
22 mol 170 unq 0 iso 0 dist 6.3247 5.97193 4.44987 9.311 9.15159 11.8056 numMergedOcc 0
23 mol 174 unq 0 iso 0 dist 8.36618 9.60153 8.16228 10.67 9.56869 5.38744 numMergedOcc 0
24 mol 183 unq 0 iso 0 dist 6.23903 7.14992 8.97652 5.24086 9.84649 4.92164 numMergedOcc 0
25 mol 183 unq 1 iso 0 dist 8.39603 10.0544 8.97652 13.0499 9.84649 4.92164 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 8.27545 4.2039 6.2016 5.31675 5.83093 6.16078 numMergedOcc 0
27 mol 209 unq 0 iso 0 dist 8.76212 4.91835 9.79293 11.0473 6.82209 8.95238 numMergedOcc 0
28 mol 212 unq 0 iso 0 dist 9.50443 11.5092 7.6819 8.78068 9.1732 6.95437 numMergedOcc 0
29 mol 212 unq 1 iso 0 dist 9.50443 13.9428 6.36102 8.78068 9.1732 9.01479 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 6.77267 4.20175 8.26312 11.0259 7.10828 13.8702 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 6.77267 4.43495 7.58554 11.0259 7.10828 8.46058 numMergedOcc 0
32 mol 241 unq 0 iso 0 dist 5.42605 6.5604 7.26758 5.67278 6.54678 4.77878 numMergedOcc 0
33 mol 243 unq 0 iso 0 dist 8.82741 7.50159 4.64178 11.6124 8.1195 7.70076 numMergedOcc 0
34 mol 243 unq 1 iso 0 dist 8.82741 14.8655 9.16988 11.6124 8.1195 16.6703 numMergedOcc 0
35 mol 243 unq 2 iso 0 dist 4.88105 4.7112 4.64178 11.0067 8.1195 7.70076 numMergedOcc 0
36 mol 243 unq 3 iso 0 dist 4.88105 9.56957 9.16988 11.0067 8.1195 16.6703 numMergedOcc 0
37 mol 243 unq 4 iso 0 dist 9.44057 8.85604 4.64178 16.3085 8.1195 7.70076 numMergedOcc 0
38 mol 243 unq 5 iso 0 dist 9.44057 6.36228 9.16988 16.3085 8.1195 16.6703 numMergedOcc 0
39 mol 258 unq 0 iso 0 dist 7.87577 4.69752 8.10903 5.06393 8.73425 5.79358 numMergedOcc 0
40 mol 258 unq 1 iso 0 dist 5.86702 4.18036 8.70193 5.06393 9.65711 7.88062 numMergedOcc 0
41 mol 258 unq 2 iso 0 dist 5.86702 4.69752 7.25618 5.06393 9.65711 5.79358 numMergedOcc 0
42 mol 281 unq 0 iso 0 dist 8.19366 7.19125 4.75349 5.39628 6.47753 5.50235 numMergedOcc 0
43 mol 281 unq 1 iso 0 dist 8.19366 7.19125 4.75349 7.203 9.69744 9.84433 numMergedOcc 0
44 mol 294 unq 0 iso 0 dist 5.25409 4.06072 6.37998 11.0408 8.46311 9.503 numMergedOcc 0
45 mol 294 unq 1 iso 0 dist 5.25409 5.29391 9.77023 11.0408 8.46311 14.1763 numMergedOcc 0
