0 mol 30 unq 0 iso 0 dist 8.61226 9.03928 5.34619 10.1647 6.79739 11.2208 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.61226 9.03928 5.34619 10.4823 5.90481 11.1773 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 6.79739 8.93805 4.61651 10.1647 8.61226 9.89655 numMergedOcc 0
3 mol 30 unq 3 iso 0 dist 6.79739 8.93805 4.61651 4.19818 5.90481 9.83449 numMergedOcc 0
4 mol 30 unq 4 iso 0 dist 5.90481 9.83449 4.61651 10.4823 8.61226 9.89655 numMergedOcc 0
5 mol 30 unq 5 iso 0 dist 5.90481 9.83449 4.61651 4.19818 6.79739 8.93805 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.60396 7.86479 4.89928 11.2822 7.48969 11.8698 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 8.57785 5.69981 3.82947 12.6714 7.03751 9.873 numMergedOcc 0
8 mol 55 unq 1 iso 0 dist 7.03751 9.873 3.82947 12.6714 8.57785 5.69981 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 5.35101 9.1791 7.4999 5.11838 8.68381 8.26586 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 5.35101 6.86485 4.99692 5.11838 8.68381 9.76234 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 5.35101 8.37546 3.70586 5.11838 8.68381 10.1165 numMergedOcc 0
12 mol 58 unq 3 iso 0 dist 8.68381 8.26586 7.4999 5.11838 5.35101 9.1791 numMergedOcc 0
13 mol 58 unq 4 iso 0 dist 8.68381 9.76234 4.99692 5.11838 5.35101 6.86485 numMergedOcc 0
14 mol 93 unq 0 iso 0 dist 8.84466 9.43355 3.91263 10.1359 8.52947 12.2152 numMergedOcc 0
15 mol 93 unq 1 iso 0 dist 8.84466 5.64141 5.59024 10.1359 8.52947 10.9933 numMergedOcc 0
16 mol 93 unq 2 iso 0 dist 8.84466 5.46186 12.9872 10.1359 8.52947 12.8106 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 5.70772 8.73613 11.5768 4.38456 5.03663 11.9772 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 5.70772 8.73613 11.5768 9.65832 8.93916 15.2832 numMergedOcc 0
19 mol 147 unq 2 iso 0 dist 8.93916 8.10157 16.3583 9.65832 5.70772 17.2542 numMergedOcc 0
20 mol 147 unq 3 iso 0 dist 8.93916 8.10157 16.3583 5.64998 5.03663 13.6564 numMergedOcc 0
21 mol 183 unq 0 iso 0 dist 8.53483 9.3066 12.2415 10.3494 8.58404 18.2515 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 4.85577 7.81696 3.85767 6.82334 9.44772 12.6991 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 7.24533 9.79864 3.98113 9.46579 9.49046 11.4533 numMergedOcc 0
24 mol 241 unq 0 iso 0 dist 7.79013 6.2767 7.9986 12.5546 9.33399 14.3983 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 9.10275 7.81168 14.4384 4.34107 9.8678 10.0108 numMergedOcc 0
26 mol 266 unq 1 iso 0 dist 6.13722 7.81168 12.9641 4.34107 8.00278 10.0108 numMergedOcc 0
