0 mol 5 unq 0 iso 0 dist 7.92988 4.05341 4.9568 6.66949 3.67097 5.69239 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 5.78968 10.4041 7.25138 10.8695 6.13411 4.46067 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 8.64534 7.57912 9.00612 8.69452 3.97053 7.23828 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.66549 11.9486 9.86038 9.27814 7.41484 4.18248 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 8.52947 7.18673 7.54391 16.3862 14.4533 9.66837 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 8.84466 6.46195 7.54391 8.61597 14.4533 9.66837 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.16344 3.68143 7.39028 12.7948 9.3283 9.51764 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 9.16344 3.68143 7.39028 11.6009 3.98588 9.29327 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.28452 3.7042 7.08403 9.68191 3.77247 7.02358 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 8.44004 12.5507 7.08403 11.9488 3.77247 7.02358 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 8.98367 10.337 5.38983 12.2109 3.81254 7.76123 numMergedOcc 0
11 mol 128 unq 1 iso 0 dist 8.98367 10.337 5.38983 14.5996 6.13996 6.08651 numMergedOcc 0
12 mol 128 unq 2 iso 0 dist 9.35162 13.5215 8.46801 16.2573 7.67031 7.76123 numMergedOcc 0
13 mol 128 unq 3 iso 0 dist 9.35162 13.5215 8.46801 13.1835 4.62046 6.08651 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.0302 3.48408 6.41183 8.34503 5.51254 5.60448 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 6.65051 5.71838 6.41183 9.6733 5.51254 5.60448 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 9.41519 10.616 6.41183 13.7236 5.51254 5.60448 numMergedOcc 0
17 mol 151 unq 0 iso 0 dist 8.29454 5.81096 8.89982 12.1622 8.61721 9.37533 numMergedOcc 0
18 mol 151 unq 1 iso 0 dist 8.25396 5.81096 6.12972 12.1622 3.96406 9.37533 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 8.56204 3.86496 7.33643 9.75644 3.89732 6.96715 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.45384 12.0957 9.14525 17.0913 13.1776 7.25595 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 7.45384 12.0957 9.14525 11.5424 4.10348 9.94825 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 6.81644 5.38511 6.46793 7.39884 3.79865 4.55853 numMergedOcc 0
