0 mol 24 unq 0 iso 0 dist 8.87744 7.27472 3.73215 10.576 4.90881 6.15382 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.87744 7.27472 3.73215 8.94148 9.39956 10.2808 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.27472 8.87744 3.73215 11.7026 8.70016 11.9118 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.27472 8.87744 3.73215 10.576 6.15382 4.90881 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 7.27472 8.87744 3.73215 6.39013 6.63216 8.10694 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 4.79873 9.48085 12.7147 7.19007 7.21175 16.2204 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.4369 8.68662 3.30399 10.4159 8.95637 11.5823 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 9.3948 9.74607 8.00584 14.2706 9.44847 13.6113 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 9.3948 9.74607 8.00584 11.0946 6.05839 11.7679 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 8.27883 5.75428 6.27231 9.82384 7.64172 11.9509 numMergedOcc 0
10 mol 95 unq 3 iso 0 dist 8.27883 8.57395 11.734 9.82384 7.64172 16.8187 numMergedOcc 0
11 mol 95 unq 4 iso 0 dist 8.27883 9.85409 17.4304 9.82384 7.64172 19.449 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.42772 9.10524 7.62195 4.87167 5.35285 11.3945 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 9.1998 8.69531 5.83782 12.3235 5.35285 6.71328 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 8.69531 9.1998 5.83782 12.3235 6.71328 5.35285 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 8.70621 5.35237 6.05407 13.8191 5.35285 11.257 numMergedOcc 0
16 mol 142 unq 0 iso 0 dist 7.81207 7.18002 13.4681 6.05056 7.80044 13.1114 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 6.84752 7.68266 3.55199 11.8729 9.12343 11.2951 numMergedOcc 0
18 mol 167 unq 1 iso 0 dist 7.86563 7.6616 3.55199 9.01215 9.12343 11.2951 numMergedOcc 0
19 mol 167 unq 2 iso 0 dist 7.02548 7.20495 6.81449 12.6156 9.12343 13.5033 numMergedOcc 0
20 mol 167 unq 3 iso 0 dist 7.02548 9.2289 3.55199 12.6156 9.12343 11.2951 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 5.64942 9.78634 5.9655 6.22871 8.70333 14.231 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 5.64942 7.43054 3.60331 6.22871 8.70333 10.0545 numMergedOcc 0
23 mol 192 unq 2 iso 0 dist 6.97962 6.79229 3.60331 4.35125 8.70333 10.0545 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 9.10817 9.73548 16.8666 13.1412 8.53485 21.5575 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 6.50998 9.09424 8.05944 7.96183 9.12682 13.1532 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 6.50998 8.14831 13.7858 7.96183 9.12682 12.6914 numMergedOcc 0
27 mol 251 unq 0 iso 0 dist 7.39775 6.50357 3.63976 8.95709 9.89035 11.1157 numMergedOcc 0
28 mol 270 unq 0 iso 0 dist 8.56508 9.31275 5.42225 6.83628 6.30711 10.5288 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 5.13913 5.46926 3.39114 9.22087 9.80035 11.0728 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 6.92711 9.35539 15.8851 13.9518 9.80035 22.7772 numMergedOcc 0
31 mol 277 unq 2 iso 0 dist 6.92711 8.9682 3.39114 13.9518 9.80035 11.0728 numMergedOcc 0
