0 mol 7 unq 0 iso 0 dist 5.51421 4.60206 5.99972 3.52338 7.78327 3.54153 7.81271 5.13353 9.68006 10.1124 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 4.37642 7.68678 6.09663 7.17488 8.76454 9.01612 5.35073 9.92355 9.23438 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 4.88613 4.37642 7.68678 6.09663 7.17488 8.76454 6.36193 4.81926 5.93884 9.9105 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 6.58793 3.88757 7.54568 12.1387 8.04242 13.5973 11.7434 10.1164 9.39864 17.4114 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.4545 12.49 8.18107 8.46944 5.42067 4.30488 7.01176 5.04493 9.8859 7.36435 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.4545 4.1125 5.9465 8.46944 5.42067 5.09449 7.01176 5.04493 6.97962 7.36435 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 8.4545 4.1125 5.9465 8.46944 5.42067 5.09449 11.7125 9.35561 9.95342 12.6375 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 7.01176 12.49 9.8859 8.46944 7.36435 4.30488 8.4545 5.04493 8.18107 5.42067 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 7.01176 4.1125 6.97962 8.46944 7.36435 5.09449 8.4545 5.04493 5.9465 5.42067 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 7.01176 4.1125 6.97962 8.46944 7.36435 5.09449 11.7125 12.7769 9.95342 12.6375 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.58911 12.0718 6.22122 3.55808 9.70481 13.4378 9.86845 6.01247 6.2479 11.8368 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 9.58911 12.0718 6.22122 3.55808 9.70481 13.4378 13.0329 12.6324 7.99195 15.9184 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 7.63036 7.14066 7.36683 8.15115 6.59544 9.10355 14.0513 10.7531 9.26504 16.1245 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.36079 10.9922 6.16414 12.9317 4.51255 9.36584 14.4684 5.63422 7.75885 6.23183 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 7.42904 8.16827 6.16414 10.8126 4.51255 9.36584 12.7047 5.63422 7.75885 6.23183 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 9.11256 3.93066 9.55668 3.76405 8.08965 6.82702 9.80261 9.89669 6.95126 12.2745 numMergedOcc 0
16 mol 235 unq 1 iso 0 dist 7.08539 13.0408 9.55668 12.0808 8.08965 6.82702 13.3861 9.89669 6.95126 12.2745 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 8.56463 5.32535 6.99315 8.84619 9.14911 5.74428 14.3699 14.5975 9.60163 11.0948 numMergedOcc 0
18 mol 237 unq 1 iso 0 dist 9.42743 11.5107 6.99315 9.06943 9.14911 5.74428 14.0442 14.5975 9.60163 11.0948 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.32451 16.2294 8.94014 4.71803 8.94231 13.4894 11.5933 5.6348 7.02333 8.88652 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.32451 16.2294 8.94014 4.71803 8.94231 13.4894 10.7555 8.87326 8.67864 6.46771 numMergedOcc 0
