0 mol 62 unq 0 iso 0 dist 9.65672 8.67162 5.38781 14.3275 9.11512 13.2139 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 9.65672 8.79114 9.2836 14.3275 9.11512 16.4753 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 9.1662 8.51942 17.5433 3.86843 6.49343 11.4423 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.52999 5.78029 6.58346 6.64985 6.79959 10.5516 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.61448 7.31633 11.3682 13.8877 8.76088 18.9418 numMergedOcc 0
5 mol 171 unq 0 iso 0 dist 6.20851 6.21194 6.4423 5.93953 6.19457 10.4881 numMergedOcc 0
6 mol 204 unq 0 iso 0 dist 8.40718 8.62191 10.8845 12.4189 6.20044 13.3097 numMergedOcc 0
7 mol 204 unq 1 iso 0 dist 8.40718 8.62191 10.8845 12.8445 8.41232 17.1393 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 8.55805 6.32097 5.45485 4.74145 6.39087 5.75839 numMergedOcc 0
9 mol 236 unq 0 iso 0 dist 5.6568 8.37813 8.52618 4.24722 7.74348 5.91739 numMergedOcc 0
10 mol 236 unq 1 iso 0 dist 5.6568 9.25988 7.35248 4.24722 7.74348 10.4578 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 9.52903 8.63176 15.1358 5.66907 8.10903 13.3737 numMergedOcc 0
12 mol 258 unq 1 iso 0 dist 9.52903 8.63176 15.1358 9.6053 7.25618 15.2741 numMergedOcc 0
13 mol 273 unq 0 iso 0 dist 6.73794 6.38341 7.10817 3.92089 5.78262 9.16554 numMergedOcc 0
14 mol 273 unq 1 iso 0 dist 6.73794 6.38341 7.10817 12.0094 7.6489 14.4972 numMergedOcc 0
15 mol 273 unq 2 iso 0 dist 6.73794 9.78826 4.30863 3.92089 5.78262 8.83491 numMergedOcc 0
16 mol 273 unq 3 iso 0 dist 6.73794 9.78826 4.30863 12.0094 7.6489 9.02711 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.47179 8.42076 12.5027 6.53276 6.45597 12.8377 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.47179 8.42076 12.5027 6.53276 6.45597 12.8377 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.47179 8.42076 12.5027 6.53276 6.45597 12.8377 numMergedOcc 0
