0 mol 33 unq 0 iso 0 dist 7.82815 6.90464 9.03138 10.264 7.73662 8.64357 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 7.82815 6.90464 9.03138 12.0101 9.68007 7.22218 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.78899 11.2385 8.63743 6.47086 7.95815 13.0605 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 6.14248 8.50377 9.78762 13.4778 9.3711 9.553 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 6.97936 16.2978 9.78762 15.1961 9.3711 9.553 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 5.00466 10.5899 9.78762 8.38148 9.3711 9.553 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 6.12663 13.2961 9.71043 13.7544 8.89939 4.54789 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 6.21094 4.54351 9.08749 4.40643 7.51011 4.78036 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 9.67398 12.7708 9.58844 12.2864 6.98077 5.74226 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 7.15213 12.7066 9.58844 7.55204 6.98077 5.74226 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 7.75518 10.8548 5.66071 6.15002 5.08438 5.11289 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 5.63283 5.07259 7.84418 6.89035 8.71347 9.60726 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.63283 6.25023 6.92823 6.89035 8.71347 5.18043 numMergedOcc 0
13 mol 217 unq 0 iso 0 dist 6.58871 7.11105 4.92885 5.07696 8.46235 9.5885 numMergedOcc 0
14 mol 217 unq 1 iso 0 dist 6.58871 7.11105 4.92885 10.8948 5.27487 7.36436 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 8.57781 6.1168 5.88041 8.09748 8.83742 10.2723 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 5.36326 9.80029 5.88041 6.63295 8.83742 10.2723 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 8.31815 10.8017 9.40158 7.27413 9.85851 4.78049 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 9.32928 6.33774 6.0567 4.28792 5.68578 5.58332 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 9.32928 6.33774 6.0567 16.9613 9.50933 14.0017 numMergedOcc 0
20 mol 239 unq 2 iso 0 dist 7.98794 8.46058 6.0567 10.6145 5.68578 5.58332 numMergedOcc 0
21 mol 239 unq 3 iso 0 dist 7.98794 8.46058 6.0567 8.52005 9.50933 14.0017 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 7.03656 9.38222 9.44618 5.72978 8.16952 4.07526 numMergedOcc 0
23 mol 279 unq 1 iso 0 dist 7.03656 9.38222 9.44618 12.744 9.67649 6.45021 numMergedOcc 0
24 mol 283 unq 0 iso 0 dist 9.83098 10.6738 5.63358 7.77415 4.86946 4.49194 numMergedOcc 0
