0 mol 10 unq 0 iso 0 dist 5.66059 6.178 5.40169 12.6968 7.71365 8.38836 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 5.99743 5.45654 8.00369 9.90359 7.50126 8.13471 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 5.99004 6.00386 7.98679 14.5084 15.0583 9.10587 numMergedOcc 0
3 mol 13 unq 1 iso 0 dist 9.65051 9.78622 7.98679 16.4304 15.0583 9.10587 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.13116 14.262 9.63403 15.4531 6.62645 8.63361 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 6.04768 10.8678 6.62972 15.5041 9.50457 7.63183 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 9.40173 13.5865 6.62972 18.0219 9.50457 7.63183 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.57532 8.70712 7.91683 14.8443 13.3975 8.03035 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.57532 8.70712 7.91683 14.8476 8.00229 7.6968 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 8.61574 6.89245 7.91683 10.4602 13.3975 8.03035 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.61574 6.89245 7.91683 11.794 8.00229 7.6968 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.61279 11.0112 6.94988 12.9765 4.98952 8.26172 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 7.38183 10.8036 6.73983 5.77628 4.38393 8.93453 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.18176 7.65994 5.06613 15.4254 7.72754 8.60521 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 8.32841 14.911 7.46845 16.8086 11.3995 5.90883 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 8.32841 14.911 7.46845 15.2186 11.6326 8.06913 numMergedOcc 0
16 mol 156 unq 2 iso 0 dist 6.56065 11.1159 7.46845 16.251 11.3995 5.90883 numMergedOcc 0
17 mol 156 unq 3 iso 0 dist 6.56065 11.1159 7.46845 16.3171 11.6326 8.06913 numMergedOcc 0
18 mol 163 unq 0 iso 0 dist 8.68243 13.082 9.79069 16.8716 15.9955 7.3546 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.09667 5.37893 5.45675 9.03496 5.91678 7.23293 numMergedOcc 0
20 mol 193 unq 0 iso 0 dist 6.28889 11.6364 8.67745 7.46207 3.98356 5.44396 numMergedOcc 0
21 mol 193 unq 1 iso 0 dist 6.28889 8.4769 9.41624 7.46207 3.98356 6.22972 numMergedOcc 0
22 mol 194 unq 0 iso 0 dist 9.819 11.802 6.37788 15.0285 5.92931 5.52678 numMergedOcc 0
23 mol 194 unq 1 iso 0 dist 9.819 12.0623 8.7028 15.0285 5.92931 9.81666 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 9.1191 9.71846 7.39391 14.6356 12.0545 8.55481 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 6.12402 5.86656 7.21655 11.5801 11.5512 5.74568 numMergedOcc 0
