0 mol 2 unq 0 iso 0 dist 9.45683 4.00237 8.38173 9.39095 5.27871 7.2721 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 10.3497 9.65174 8.6586 4.21283 8.25818 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.46609 9.54853 9.41425 15.8935 14.8703 8.28202 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 9.00593 3.45063 5.70238 12.4501 5.51163 9.89219 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 7.27883 13.9292 9.31883 13.1032 5.9339 9.48125 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 7.27883 7.10408 6.29842 10.1314 4.06864 6.38866 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 5.9644 6.42684 4.92457 13.5118 8.45456 8.14512 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.42713 14.4533 6.46217 7.54391 6.15015 9.66837 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 8.21032 3.24551 6.46217 11.756 6.15015 9.66837 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 9.82548 14.3069 4.72339 13.2106 4.26808 4.91212 numMergedOcc 0
10 mol 111 unq 1 iso 0 dist 9.82548 14.3069 4.72339 17.8513 10.1254 9.74162 numMergedOcc 0
11 mol 111 unq 2 iso 0 dist 9.82548 10.8119 7.21505 13.2106 4.26808 9.34782 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 6.20553 3.77247 8.28325 7.08403 6.39863 7.02358 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 6.17362 3.81254 7.12765 5.38983 4.21194 7.76123 numMergedOcc 0
14 mol 128 unq 1 iso 0 dist 6.17362 6.13996 6.28471 5.38983 4.21194 6.08651 numMergedOcc 0
15 mol 128 unq 2 iso 0 dist 6.4416 7.67031 7.12765 8.46801 4.21194 7.76123 numMergedOcc 0
16 mol 128 unq 3 iso 0 dist 6.4416 4.62046 6.28471 8.46801 4.21194 6.08651 numMergedOcc 0
17 mol 128 unq 4 iso 0 dist 6.91935 4.79627 7.12765 9.1479 4.21194 7.76123 numMergedOcc 0
18 mol 128 unq 5 iso 0 dist 6.91935 4.769 6.28471 9.1479 4.21194 6.08651 numMergedOcc 0
19 mol 147 unq 0 iso 0 dist 6.4752 11.3398 7.19893 12.3949 7.88487 5.19116 numMergedOcc 0
20 mol 147 unq 1 iso 0 dist 6.4752 11.3398 7.19893 13.8646 8.40786 8.71702 numMergedOcc 0
21 mol 151 unq 0 iso 0 dist 5.87912 9.75631 9.06016 13.4653 15.4563 9.37533 numMergedOcc 0
22 mol 151 unq 1 iso 0 dist 7.06678 8.95545 9.06016 16.7179 15.4563 9.37533 numMergedOcc 0
23 mol 169 unq 0 iso 0 dist 6.29631 3.89732 8.21203 7.33643 6.28641 6.96715 numMergedOcc 0
24 mol 213 unq 0 iso 0 dist 8.91912 12.2295 7.79105 14.2185 5.61301 9.56126 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 9.49955 10.1458 9.67093 14.6332 10.2758 9.64861 numMergedOcc 0
26 mol 250 unq 0 iso 0 dist 9.43554 7.81555 7.5999 14.8822 6.28121 9.81716 numMergedOcc 0
27 mol 250 unq 1 iso 0 dist 9.21681 16.7301 7.5999 10.4571 6.28121 9.81716 numMergedOcc 0
