0 mol 53 unq 0 iso 0 dist 7.08383 9.26043 6.98616 10.0759 12.5652 7.86285 numMergedOcc 0
1 mol 53 unq 1 iso 0 dist 7.08383 7.72123 10.4874 7.13301 9.18436 8.79235 numMergedOcc 0
2 mol 128 unq 0 iso 0 dist 8.54297 8.20389 5.18427 10.6485 7.11781 5.23695 numMergedOcc 0
3 mol 128 unq 1 iso 0 dist 9.35162 8.20389 3.93522 10.6485 9.07603 5.23695 numMergedOcc 0
4 mol 132 unq 0 iso 0 dist 8.94096 5.52837 7.71763 4.78213 12.8009 8.62632 numMergedOcc 0
5 mol 132 unq 1 iso 0 dist 7.64207 5.52837 7.53392 4.78213 12.2564 8.62632 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.86691 8.72732 14.0828 5.25744 10.2321 5.9959 numMergedOcc 0
7 mol 146 unq 0 iso 0 dist 5.3184 6.70014 11.6962 3.75935 6.93154 5.50187 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.99743 8.87968 7.46995 10.9596 13.9492 6.95244 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 9.99743 8.87968 7.46995 8.8578 9.26656 6.11224 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 7.38022 5.51354 5.55907 3.85734 10.1404 7.9987 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 8.6856 9.44669 6.30651 14.2548 15.1089 9.81589 numMergedOcc 0
12 mol 258 unq 1 iso 0 dist 9.98868 9.44669 10.8524 14.2548 18.4616 9.81589 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 6.86805 9.70632 6.31111 6.11441 6.22195 4.93584 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 9.10275 7.07099 10.5702 13.8362 16.2448 8.95841 numMergedOcc 0
15 mol 266 unq 2 iso 0 dist 6.13722 7.07099 6.1113 13.8362 11.9041 8.95841 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.53542 8.93979 6.05412 12.3223 11.3536 7.03656 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.83056 13.1806 7.19568 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.83056 9.27722 7.19568 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.83056 13.1806 7.19568 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.83056 9.27722 7.19568 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.83056 13.1806 7.19568 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.83056 9.27722 7.19568 numMergedOcc 0
