0 mol 1 unq 0 iso 0 dist 7.21349 7.90928 9.45781 11.5824 16.1051 9.78935 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 4.81943 4.56325 4.22842 9.86184 11.018 8.4702 numMergedOcc 0
2 mol 6 unq 1 iso 0 dist 4.81943 8.06002 5.34599 9.86184 11.018 8.51898 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 9.36227 8.16743 12.0906 10.4163 18.0216 8.6405 numMergedOcc 0
4 mol 13 unq 0 iso 0 dist 7.71544 9.37413 11.4587 5.86973 11.6449 6.80105 numMergedOcc 0
5 mol 13 unq 1 iso 0 dist 7.71544 9.37413 11.4587 7.45016 12.8439 7.14622 numMergedOcc 0
6 mol 37 unq 0 iso 0 dist 6.64605 6.69711 4.21185 13.9469 11.2419 8.50293 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 9.59131 8.91418 5.14132 13.911 8.45063 6.59367 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 4.67917 8.17564 8.85727 6.07398 5.41134 8.10708 numMergedOcc 0
9 mol 59 unq 1 iso 0 dist 4.67917 8.17564 8.85727 13.9662 13.3267 8.42956 numMergedOcc 0
10 mol 59 unq 2 iso 0 dist 4.67917 8.17564 8.85727 11.9466 9.23605 9.20253 numMergedOcc 0
11 mol 59 unq 3 iso 0 dist 5.81747 8.17564 4.07863 6.07398 8.61357 8.10708 numMergedOcc 0
12 mol 59 unq 4 iso 0 dist 5.81747 8.17564 4.07863 13.9662 12.2093 8.42956 numMergedOcc 0
13 mol 59 unq 5 iso 0 dist 5.81747 8.17564 4.07863 11.9466 11.3905 9.20253 numMergedOcc 0
14 mol 59 unq 6 iso 0 dist 6.88924 7.19213 8.85727 4.58297 5.41134 8.10708 numMergedOcc 0
15 mol 59 unq 7 iso 0 dist 6.88924 7.19213 8.85727 11.3605 13.3267 8.42956 numMergedOcc 0
16 mol 59 unq 8 iso 0 dist 6.88924 7.19213 8.85727 10.8174 9.23605 9.20253 numMergedOcc 0
17 mol 59 unq 9 iso 0 dist 6.81975 7.19213 4.07863 4.58297 8.61357 8.10708 numMergedOcc 0
18 mol 59 unq 10 iso 0 dist 6.81975 7.19213 4.07863 11.3605 12.2093 8.42956 numMergedOcc 0
19 mol 59 unq 11 iso 0 dist 6.81975 7.19213 4.07863 10.8174 11.3905 9.20253 numMergedOcc 0
20 mol 76 unq 0 iso 0 dist 9.4022 8.39101 4.42702 7.08972 8.8247 8.84839 numMergedOcc 0
21 mol 88 unq 0 iso 0 dist 8.00003 9.75205 10.8145 9.74696 10.3711 5.92974 numMergedOcc 0
22 mol 183 unq 0 iso 0 dist 8.15747 7.42108 9.54124 12.7618 15.2325 8.57818 numMergedOcc 0
23 mol 183 unq 1 iso 0 dist 5.44125 7.42108 9.81014 12.7618 15.3562 8.57818 numMergedOcc 0
24 mol 183 unq 2 iso 0 dist 8.7143 9.19941 9.81014 9.68909 15.3562 8.57818 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 8.80167 9.39099 16.3761 9.18058 16.911 6.96139 numMergedOcc 0
26 mol 226 unq 0 iso 0 dist 9.37229 9.31669 4.91346 6.92911 7.54614 7.45381 numMergedOcc 0
27 mol 233 unq 0 iso 0 dist 7.74693 7.83363 5.3674 8.42399 10.4618 5.64376 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 9.51177 9.46582 13.1765 4.13744 11.8266 6.40309 numMergedOcc 0
29 mol 238 unq 1 iso 0 dist 9.51177 9.77231 14.6367 4.13744 11.8266 7.87164 numMergedOcc 0
30 mol 247 unq 0 iso 0 dist 9.65548 9.6455 4.32191 15.0183 14.0255 9.70618 numMergedOcc 0
