0 mol 4 unq 0 iso 0 dist 6.12485 7.88748 4.10578 5.52224 8.81559 12.123 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 7.44828 7.82815 13.4442 13.6327 9.8482 21.3063 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.53081 6.68961 5.93341 10.7098 8.82709 12.4791 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 5.06188 7.78899 4.55422 11.0408 9.16212 10.9319 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 5.2184 8.93181 3.84072 4.96177 7.89317 11.5918 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.52061 8.57774 11.7456 5.9261 6.52844 9.8591 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 7.6453 9.31543 9.82512 8.73165 9.7113 10.0995 numMergedOcc 0
7 mol 129 unq 2 iso 0 dist 7.6453 8.85652 6.31483 8.73165 9.7113 6.34626 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.40718 8.39573 9.76508 14.1039 9.2933 10.5303 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 9.40718 8.39573 9.76508 5.39949 8.77781 5.99437 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 5.61326 7.75518 4.3166 8.18632 9.854 11.9372 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 5.86839 6.50586 3.73699 8.3451 9.37516 8.31721 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 5.86911 8.44407 4.54444 5.74127 5.82124 5.31416 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 5.86911 6.0155 7.05353 5.74127 5.82124 5.44533 numMergedOcc 0
14 mol 214 unq 2 iso 0 dist 5.86911 8.89981 12.9344 5.74127 5.82124 14.5823 numMergedOcc 0
15 mol 214 unq 3 iso 0 dist 7.89258 8.44407 5.33718 5.74127 8.31236 5.31416 numMergedOcc 0
16 mol 214 unq 4 iso 0 dist 7.89258 6.0155 5.12324 5.74127 8.31236 5.44533 numMergedOcc 0
17 mol 214 unq 5 iso 0 dist 7.89258 8.89981 12.8738 5.74127 8.31236 14.5823 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 6.39087 8.63649 4.4227 5.45485 5.75839 9.23863 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.03925 8.57781 4.67513 5.93235 6.84722 5.05368 numMergedOcc 0
20 mol 255 unq 0 iso 0 dist 7.57779 7.58813 8.06922 6.1967 8.88059 11.4852 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.57274 9.81589 15.1125 12.3617 7.87648 21.2181 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 5.78262 8.66133 5.53908 7.10817 9.16554 7.85836 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 5.78262 8.66133 5.53908 4.30863 8.83491 12.528 numMergedOcc 0
24 mol 273 unq 2 iso 0 dist 5.78262 6.95569 12.7125 7.10817 9.16554 10.5213 numMergedOcc 0
25 mol 273 unq 3 iso 0 dist 5.78262 6.95569 12.7125 4.30863 8.83491 5.61969 numMergedOcc 0
26 mol 273 unq 4 iso 0 dist 7.6489 8.66133 12.7274 4.30863 9.02711 12.528 numMergedOcc 0
27 mol 273 unq 5 iso 0 dist 7.6489 6.95569 10.8576 4.30863 9.02711 5.61969 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 8.15119 9.91103 13.1828 12.7485 9.35976 9.26157 numMergedOcc 0
29 mol 277 unq 1 iso 0 dist 8.15119 7.0603 10.6994 12.7485 9.35976 9.11117 numMergedOcc 0
