0 mol 4 unq 0 iso 0 dist 6.10734 9.97548 8.93987 6.21799 5.58487 13.8017 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 5.99743 8.98746 7.60549 5.45654 8.00369 13.5977 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 5.81645 9.80946 12.6428 5.75226 7.03307 10.731 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 6.75026 9.80946 8.28169 5.75226 7.25707 10.731 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 6.04768 8.73798 10.256 10.8678 6.62972 11.9789 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 9.40173 5.24616 10.256 13.5865 6.62972 11.9789 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 6.87196 8.12319 3.88766 11.923 9.13191 12.7928 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 5.43662 8.44004 5.92118 6.3223 6.48674 10.6435 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.38183 4.93944 3.80763 10.8036 6.73983 8.88454 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 7.38183 4.93944 3.80763 12.1363 8.6387 9.48581 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.09667 7.62945 5.39534 5.37893 5.45675 8.46395 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 6.28889 6.10013 6.18551 11.6364 8.67745 10.3541 numMergedOcc 0
12 mol 193 unq 1 iso 0 dist 6.28889 6.10013 6.18551 8.4769 9.41624 7.06636 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 9.819 7.26295 3.7326 11.802 6.37788 5.13892 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 9.819 7.26295 3.7326 12.0623 8.7028 8.2232 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 9.819 7.31316 7.29209 11.802 6.37788 5.78717 numMergedOcc 0
16 mol 194 unq 3 iso 0 dist 9.819 7.31316 7.29209 12.0623 8.7028 10.3448 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.62013 5.8294 6.52211 6.80235 5.91727 9.92086 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 8.78652 8.44451 5.88175 5.20757 5.57779 8.83523 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 9.01437 8.44451 9.89707 5.20757 7.05649 8.83523 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 9.1191 7.38867 3.99887 9.71846 7.39391 8.38453 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 6.8256 8.81508 8.63927 8.24228 9.43042 15.5871 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 9.23037 8.38399 8.78384 11.8168 6.74142 11.2478 numMergedOcc 0
