0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 6.40255 8.13129 6.15923 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.6994 8.81979 5.63197 6.40255 8.13129 10.9954 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 7.15528 9.23213 10.4498 6.40255 9.07223 6.15923 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.15528 8.81979 5.52201 6.40255 9.07223 10.9954 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 8.38064 8.21493 5.90976 5.88545 7.876 9.90484 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 9.97507 7.12903 5.90976 8.20465 7.876 9.90484 numMergedOcc 0
6 mol 15 unq 2 iso 0 dist 6.82505 7.12903 5.51916 8.20465 8.63502 9.90484 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 7.20519 9.80108 5.5841 6.63929 7.97324 12.1778 numMergedOcc 0
8 mol 19 unq 1 iso 0 dist 6.864 8.58657 5.5841 11.8689 7.97324 12.1778 numMergedOcc 0
9 mol 26 unq 0 iso 0 dist 8.34347 9.16962 11.887 9.49511 7.47201 15.8004 numMergedOcc 0
10 mol 54 unq 0 iso 0 dist 9.5589 5.02241 6.91765 8.17454 7.56581 9.34242 numMergedOcc 0
11 mol 54 unq 1 iso 0 dist 6.83299 5.02241 5.06052 8.17454 9.22021 9.34242 numMergedOcc 0
12 mol 72 unq 0 iso 0 dist 9.96708 7.321 9.0131 4.45372 8.96978 10.5141 numMergedOcc 0
13 mol 88 unq 0 iso 0 dist 9.36773 9.2603 6.95868 6.81076 6.066 8.01572 numMergedOcc 0
14 mol 88 unq 1 iso 0 dist 8.31336 9.2603 6.97239 6.81076 9.36032 8.01572 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 7.17106 6.58204 5.01145 8.07089 8.20656 11.8307 numMergedOcc 0
16 mol 100 unq 1 iso 0 dist 9.35224 6.58204 5.69137 6.35939 7.5951 6.60772 numMergedOcc 0
17 mol 100 unq 2 iso 0 dist 6.56369 7.75343 5.69137 4.46114 7.5951 6.60772 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 11.3981 6.69217 16.6837 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 6.18601 9.80862 9.35964 10.6133 9.70093 16.6624 numMergedOcc 0
20 mol 119 unq 2 iso 0 dist 6.18601 8.43904 10.3457 10.6133 9.70093 15.0241 numMergedOcc 0
21 mol 127 unq 0 iso 0 dist 9.30299 9.81878 4.77464 10.7123 5.72373 6.11979 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 7.11802 7.92688 4.68409 6.56917 9.64695 12.8527 numMergedOcc 0
23 mol 133 unq 1 iso 0 dist 8.00618 7.92688 12.2037 6.56917 4.51266 12.8527 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 9.29945 9.52634 9.11521 5.32538 6.95549 9.37196 numMergedOcc 0
25 mol 175 unq 1 iso 0 dist 9.0018 9.8589 8.22779 8.19969 5.08591 10.2731 numMergedOcc 0
26 mol 175 unq 2 iso 0 dist 7.652 7.24908 8.22779 5.33769 5.08591 10.2731 numMergedOcc 0
27 mol 175 unq 3 iso 0 dist 5.6234 9.8589 10.5631 8.19969 8.03727 10.2731 numMergedOcc 0
28 mol 175 unq 4 iso 0 dist 9.92231 7.24908 10.5631 5.33769 8.03727 10.2731 numMergedOcc 0
29 mol 178 unq 0 iso 0 dist 7.17202 8.96511 12.075 6.39077 7.12045 13.8596 numMergedOcc 0
30 mol 178 unq 1 iso 0 dist 8.81551 8.96511 9.92132 6.39077 8.94945 13.8596 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 7.81386 4.93785 6.7991 7.45927 8.47008 10.9771 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 7.63312 6.93764 4.80231 5.83639 8.47008 10.3476 numMergedOcc 0
33 mol 239 unq 0 iso 0 dist 7.00034 7.39747 6.26168 6.41859 6.09177 10.9647 numMergedOcc 0
34 mol 239 unq 1 iso 0 dist 7.00034 7.39747 6.26168 9.00586 7.18198 9.81396 numMergedOcc 0
35 mol 239 unq 2 iso 0 dist 7.00034 8.1777 5.39146 6.41859 6.09177 10.1569 numMergedOcc 0
36 mol 239 unq 3 iso 0 dist 7.00034 8.1777 5.39146 9.00586 7.18198 11.9085 numMergedOcc 0
37 mol 248 unq 0 iso 0 dist 7.21521 6.07192 5.51827 5.41499 9.12664 8.79594 numMergedOcc 0
38 mol 248 unq 1 iso 0 dist 8.2965 6.07192 9.29921 5.41499 6.51383 8.79594 numMergedOcc 0
39 mol 274 unq 0 iso 0 dist 8.49997 7.97444 6.8406 8.58007 6.92434 10.4335 numMergedOcc 0
40 mol 274 unq 1 iso 0 dist 8.49997 7.97444 6.8406 5.66046 6.93875 6.44447 numMergedOcc 0
41 mol 274 unq 2 iso 0 dist 8.49997 7.97444 6.8406 10.1323 6.0868 9.84018 numMergedOcc 0
42 mol 274 unq 3 iso 0 dist 8.49997 7.97444 6.8406 13.5073 6.32856 11.5746 numMergedOcc 0
