0 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 16.9963 9.71584 6.10339 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.18518 6.57145 4.54938 9.47909 10.2774 6.50337 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.35095 5.76725 5.54419 11.3284 7.6222 8.80127 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 5.87895 5.75653 7.36323 13.8542 11.7026 8.80127 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.22376 5.75796 7.47541 11.9946 11.3211 8.77199 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 9.22376 3.85308 7.66905 11.9946 11.3211 8.81824 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.40559 13.018 7.27724 21.1933 14.2706 8.69749 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 9.40559 13.018 7.27724 17.4241 11.0946 5.96576 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 6.65963 10.345 8.14887 7.34368 6.3084 8.82676 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 7.73139 11.0785 9.30299 12.9656 12.4721 8.82676 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 6.66607 8.89539 9.30299 15.7383 12.4721 8.82676 numMergedOcc 0
11 mol 127 unq 3 iso 0 dist 8.62711 10.345 9.30299 7.34368 12.4721 8.82676 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 7.83781 6.43506 9.87651 7.78684 6.38496 5.72735 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 9.36307 9.72559 9.31746 15.4111 9.87473 9.07173 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.45401 6.8549 7.54065 9.06551 4.527 9.83935 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 6.86297 8.03427 8.87694 14.5302 9.6018 9.83935 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 7.04127 4.55824 6.61986 9.55911 4.32714 7.80754 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 7.04127 4.55824 6.61986 11.9468 8.95149 8.20295 numMergedOcc 0
18 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 15.3675 6.58152 7.31553 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 7.80525 4.84708 7.32223 10.8437 3.87128 9.29422 numMergedOcc 0
20 mol 253 unq 1 iso 0 dist 7.71295 4.84708 8.31064 10.8437 10.8347 9.29422 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.35794 5.77904 9.7748 11.6319 10.9417 6.64082 numMergedOcc 0
