0 mol 2 unq 0 iso 0 dist 8.66033 14.6076 6.52386 9.54857 9.57674 11.3269 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.54324 9.8254 6.52386 6.97183 9.57674 11.3269 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.81871 9.2768 5.77374 6.13582 5.27578 4.01354 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 9.71959 9.2768 8.57437 6.13582 8.94586 4.01354 numMergedOcc 0
4 mol 13 unq 0 iso 0 dist 9.2878 8.77656 5.4424 11.5415 9.57675 14.2898 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 4.52881 4.61354 7.85573 9.5746 7.42925 9.64095 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 4.52881 6.03595 6.21423 9.5746 7.42925 4.83412 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 9.22881 7.90703 6.23298 4.61203 9.30836 7.29309 numMergedOcc 0
8 mol 67 unq 1 iso 0 dist 9.22881 7.90703 6.23298 6.83553 6.58279 4.31746 numMergedOcc 0
9 mol 67 unq 2 iso 0 dist 9.22881 6.12484 9.85405 4.61203 9.30836 7.83316 numMergedOcc 0
10 mol 67 unq 3 iso 0 dist 9.22881 6.12484 9.85405 6.83553 6.58279 7.58981 numMergedOcc 0
11 mol 67 unq 4 iso 0 dist 4.52009 8.59074 6.23298 7.92725 9.30836 7.29309 numMergedOcc 0
12 mol 67 unq 5 iso 0 dist 4.52009 8.59074 6.23298 7.26324 6.58279 4.31746 numMergedOcc 0
13 mol 67 unq 6 iso 0 dist 4.52009 10.4436 9.85405 7.92725 9.30836 7.83316 numMergedOcc 0
14 mol 67 unq 7 iso 0 dist 4.52009 10.4436 9.85405 7.26324 6.58279 7.58981 numMergedOcc 0
15 mol 67 unq 8 iso 0 dist 8.28902 8.36652 6.23298 10.5931 9.30836 7.29309 numMergedOcc 0
16 mol 67 unq 9 iso 0 dist 8.28902 8.36652 6.23298 10.2724 6.58279 4.31746 numMergedOcc 0
17 mol 67 unq 10 iso 0 dist 8.28902 6.53985 9.85405 10.5931 9.30836 7.83316 numMergedOcc 0
18 mol 67 unq 11 iso 0 dist 8.28902 6.53985 9.85405 10.2724 6.58279 7.58981 numMergedOcc 0
19 mol 83 unq 0 iso 0 dist 6.21251 6.40918 6.98121 7.7133 9.50228 5.93743 numMergedOcc 0
20 mol 89 unq 0 iso 0 dist 5.37527 5.97457 7.24906 6.64741 9.67681 8.8602 numMergedOcc 0
21 mol 100 unq 0 iso 0 dist 8.07051 11.6306 8.52125 5.22561 9.95103 12.9454 numMergedOcc 0
22 mol 103 unq 0 iso 0 dist 6.13194 6.21393 6.71671 9.41836 9.5002 4.1431 numMergedOcc 0
23 mol 119 unq 0 iso 0 dist 9.39818 6.17994 5.28955 8.10869 6.13508 4.09788 numMergedOcc 0
24 mol 119 unq 1 iso 0 dist 8.91758 7.72465 5.28955 10.3501 6.13508 4.09788 numMergedOcc 0
25 mol 127 unq 0 iso 0 dist 6.46753 4.8564 8.88979 6.77464 8.70738 10.0555 numMergedOcc 0
26 mol 131 unq 0 iso 0 dist 6.30762 9.30741 8.89412 6.92937 9.39811 7.25148 numMergedOcc 0
27 mol 133 unq 0 iso 0 dist 4.84604 9.45934 6.85651 6.13661 8.70392 14.4497 numMergedOcc 0
28 mol 133 unq 1 iso 0 dist 4.84604 5.10912 7.03858 6.13661 8.70392 9.26708 numMergedOcc 0
29 mol 148 unq 0 iso 0 dist 8.42082 5.92269 5.55129 6.35087 7.32163 5.03347 numMergedOcc 0
30 mol 150 unq 0 iso 0 dist 8.47493 5.95123 5.53778 6.38252 7.42372 4.80033 numMergedOcc 0
31 mol 185 unq 0 iso 0 dist 9.94658 12.445 5.40655 17.4957 8.56136 6.26644 numMergedOcc 0
32 mol 205 unq 0 iso 0 dist 9.10711 13.3146 8.56656 5.86273 9.28818 9.07051 numMergedOcc 0
33 mol 265 unq 0 iso 0 dist 9.09556 4.86861 6.98812 9.59458 7.49913 10.7881 numMergedOcc 0
34 mol 294 unq 0 iso 0 dist 5.49473 9.32871 5.27236 5.85169 6.1268 7.33654 numMergedOcc 0
