0 mol 24 unq 0 iso 0 dist 9.40479 9.65174 13.3652 9.57743 8.24948 7.7447 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.58012 9.65174 6.79749 9.57743 11.96 7.7447 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 5.51624 9.30843 5.99863 4.97727 7.8435 8.28591 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 5.51624 9.30843 5.99863 5.77343 5.99269 5.35008 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 5.51624 9.30843 5.99863 11.0802 5.71763 8.30921 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 7.8674 6.25522 5.99863 13.8087 7.8435 8.28591 numMergedOcc 0
6 mol 93 unq 4 iso 0 dist 7.8674 6.25522 5.99863 9.96831 5.99269 5.35008 numMergedOcc 0
7 mol 93 unq 5 iso 0 dist 7.8674 6.25522 5.99863 5.33894 5.71763 8.30921 numMergedOcc 0
8 mol 93 unq 6 iso 0 dist 7.8674 7.87145 6.15015 13.8087 7.8435 9.40687 numMergedOcc 0
9 mol 93 unq 7 iso 0 dist 7.8674 7.87145 6.15015 9.96831 5.99269 8.84576 numMergedOcc 0
10 mol 93 unq 8 iso 0 dist 7.8674 7.87145 6.15015 5.33894 5.71763 7.39732 numMergedOcc 0
11 mol 93 unq 9 iso 0 dist 7.8674 9.30914 10.9803 5.33894 5.71763 9.67744 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.03035 7.62197 10.7475 6.71103 9.6121 4.55071 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 7.76594 4.48699 9.93041 4.24991 6.78801 8.49847 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 5.73236 7.22 5.42311 6.16103 8.68663 6.60366 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 8.60521 5.42715 4.78989 10.6183 7.1069 8.60651 numMergedOcc 0
16 mol 152 unq 1 iso 0 dist 6.39031 7.34557 4.78989 4.71678 7.1069 8.60651 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.12349 9.12783 6.3786 12.0756 12.0771 7.36794 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 8.12349 9.12783 6.3786 9.57029 7.04815 5.81881 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 7.23293 8.46395 9.42515 12.8784 9.9976 9.34653 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 5.52678 5.13892 7.82899 5.28603 5.53324 4.45769 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 5.52678 5.13892 7.82899 10.7058 11.4466 8.99961 numMergedOcc 0
22 mol 194 unq 2 iso 0 dist 5.52678 5.78717 10.0237 5.28603 5.53324 5.89939 numMergedOcc 0
23 mol 194 unq 3 iso 0 dist 5.52678 5.78717 10.0237 10.7058 11.4466 8.18853 numMergedOcc 0
24 mol 194 unq 4 iso 0 dist 9.81666 8.2232 7.82899 11.0713 5.53324 4.45769 numMergedOcc 0
25 mol 194 unq 5 iso 0 dist 9.81666 8.2232 7.82899 16.9177 11.4466 8.99961 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 9.06334 6.62738 3.98561 3.85314 9.82048 6.17843 numMergedOcc 0
27 mol 218 unq 1 iso 0 dist 9.06334 7.13254 5.11748 3.85314 9.82048 8.52772 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 8.55481 8.38453 14.8966 4.34126 5.9974 9.81261 numMergedOcc 0
29 mol 260 unq 0 iso 0 dist 8.3149 4.64695 4.05076 13.067 9.65775 9.73217 numMergedOcc 0
30 mol 260 unq 1 iso 0 dist 8.3149 4.64695 4.05076 5.38958 9.50634 7.49606 numMergedOcc 0
31 mol 260 unq 2 iso 0 dist 8.3149 4.64695 4.05076 6.07718 10.9964 8.06377 numMergedOcc 0
