0 mol 7 unq 0 iso 0 dist 9.02869 5.83658 5.37308 4.91115 7.11539 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.38748 6.22892 5.0893 15.5737 12.1991 9.68596 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.5937 6.53817 10.1064 10.8117 19.0134 9.78331 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 7.34681 6.53817 13.5023 10.8117 17.2477 9.78331 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 7.69637 6.85331 9.1927 10.7574 15.0122 7.33768 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 7.69637 6.85331 9.1927 15.2995 16.1 9.01567 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 7.69637 6.85331 9.1927 12.8157 10.9641 7.29868 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 9.22152 5.87895 6.7228 5.076 12.7129 9.12854 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 8.204 8.37503 11.4088 7.07473 11.8411 8.1284 numMergedOcc 0
9 mol 33 unq 0 iso 0 dist 8.37901 5.66319 7.83082 10.4368 16.2777 8.83487 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 7.18976 7.23052 5.1738 5.34732 9.94532 6.96281 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.8353 9.89098 16.1558 11.7971 20.4345 9.97654 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 5.40826 7.5984 9.02772 11.4055 15.0939 7.78652 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 5.40826 7.5984 9.02772 9.54731 14.3233 8.91301 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.19457 6.01711 6.89436 6.4423 10.4881 9.61462 numMergedOcc 0
15 mol 174 unq 0 iso 0 dist 8.16228 7.03029 4.69892 6.97204 8.39178 8.87569 numMergedOcc 0
16 mol 174 unq 1 iso 0 dist 8.16228 7.03029 4.69892 9.84841 7.54918 9.87122 numMergedOcc 0
17 mol 174 unq 2 iso 0 dist 8.57467 7.03029 4.99043 6.97204 12.2017 8.87569 numMergedOcc 0
18 mol 174 unq 3 iso 0 dist 8.57467 7.03029 4.99043 9.84841 12.5389 9.87122 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 8.92801 9.63295 9.40823 14.1039 14.4508 5.9176 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 8.92801 9.63295 9.40823 5.39949 8.70756 6.41453 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 9.40718 9.63295 5.32364 14.1039 9.2933 5.9176 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 9.40718 9.63295 5.32364 5.39949 8.77781 6.41453 numMergedOcc 0
23 mol 223 unq 0 iso 0 dist 6.97426 9.94212 15.9255 10.5593 16.3099 7.48463 numMergedOcc 0
24 mol 223 unq 1 iso 0 dist 8.87456 9.94212 17.7343 10.5593 16.0313 7.48463 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 7.19218 6.83069 5.36005 10.24 11.0543 6.68687 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 9.8165 7.46199 6.98979 7.71103 15.7332 9.96262 numMergedOcc 0
27 mol 273 unq 0 iso 0 dist 5.78262 6.54753 4.77695 7.10817 9.16554 8.83865 numMergedOcc 0
28 mol 273 unq 1 iso 0 dist 7.6489 6.54753 9.01117 7.10817 14.4972 8.83865 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.34051 9.81087 7.24261 13.6675 14.5258 7.46394 numMergedOcc 0
30 mol 284 unq 0 iso 0 dist 7.66585 7.35866 7.26724 5.40432 11.1074 9.33437 numMergedOcc 0
31 mol 284 unq 1 iso 0 dist 7.66585 7.32482 5.44847 5.40432 11.1074 7.8343 numMergedOcc 0
32 mol 284 unq 2 iso 0 dist 7.74965 8.08993 4.76222 7.98227 11.4208 7.8343 numMergedOcc 0
33 mol 284 unq 3 iso 0 dist 7.74965 7.34344 13.4636 6.50962 13.9565 6.78191 numMergedOcc 0
