0 mol 24 unq 0 iso 0 dist 8.24948 13.3652 7.7447 9.40479 9.57743 9.65174 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 7.17026 4.74563 6.23509 12.9134 9.30293 8.64444 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 7.8435 5.99863 8.28591 5.51624 4.97727 9.30843 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 7.8435 5.99863 8.28591 7.8674 13.8087 6.25522 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 7.8435 6.15015 9.40687 7.8674 13.8087 7.87145 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 5.99269 5.99863 5.35008 5.51624 5.77343 9.30843 numMergedOcc 0
6 mol 93 unq 4 iso 0 dist 5.99269 5.99863 5.35008 7.8674 9.96831 6.25522 numMergedOcc 0
7 mol 93 unq 5 iso 0 dist 5.99269 6.15015 8.84576 7.8674 9.96831 7.87145 numMergedOcc 0
8 mol 93 unq 6 iso 0 dist 5.71763 5.99863 8.30921 5.51624 11.0802 9.30843 numMergedOcc 0
9 mol 93 unq 7 iso 0 dist 5.71763 5.99863 8.30921 7.8674 5.33894 6.25522 numMergedOcc 0
10 mol 93 unq 8 iso 0 dist 5.71763 6.15015 7.39732 7.8674 5.33894 7.87145 numMergedOcc 0
11 mol 93 unq 9 iso 0 dist 5.71763 10.9803 9.67744 7.8674 5.33894 9.30914 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 4.99604 4.25001 5.92828 12.0448 8.90959 9.34689 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.6121 10.7475 4.55071 16.6372 9.75037 8.34342 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 9.6121 10.7475 4.55071 8.03035 6.71103 7.62197 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 9.6121 10.7475 4.55071 19.7237 12.6399 9.31621 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 6.78801 9.93041 8.49847 7.76594 4.24991 4.48699 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 8.68663 5.42311 6.60366 5.73236 6.16103 7.22 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 7.1069 4.78989 8.60651 8.60521 10.6183 5.42715 numMergedOcc 0
19 mol 152 unq 1 iso 0 dist 7.1069 4.78989 8.60651 6.39031 4.71678 7.34557 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 5.48379 6.02991 6.77583 13.9481 12.4672 8.06621 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 7.04815 6.3786 5.81881 8.12349 9.57029 9.12783 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 8.31881 9.09659 9.34653 13.3793 12.8784 8.46395 numMergedOcc 0
23 mol 186 unq 2 iso 0 dist 8.31881 9.09659 9.34653 12.7425 8.88593 6.08596 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 5.53324 7.82899 4.45769 5.52678 5.28603 5.13892 numMergedOcc 0
25 mol 194 unq 1 iso 0 dist 5.53324 7.82899 4.45769 9.81666 11.0713 8.2232 numMergedOcc 0
26 mol 194 unq 2 iso 0 dist 5.53324 10.0237 5.89939 5.52678 5.28603 5.78717 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 9.39658 19.1465 9.81261 11.8525 4.34126 8.38453 numMergedOcc 0
28 mol 252 unq 1 iso 0 dist 5.9974 14.8966 9.81261 8.55481 4.34126 8.38453 numMergedOcc 0
29 mol 260 unq 0 iso 0 dist 9.65775 4.05076 9.73217 12.4491 9.36822 9.25019 numMergedOcc 0
30 mol 260 unq 1 iso 0 dist 9.65775 4.05076 9.73217 8.3149 13.067 4.64695 numMergedOcc 0
31 mol 260 unq 2 iso 0 dist 9.50634 4.05076 7.49606 12.4491 14.1637 9.25019 numMergedOcc 0
32 mol 260 unq 3 iso 0 dist 9.50634 4.05076 7.49606 8.3149 5.38958 4.64695 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 5.8304 7.93548 4.98693 13.8337 8.11749 8.17846 numMergedOcc 0
