0 mol 33 unq 0 iso 0 dist 8.41842 5.73206 4.77227 8.78909 10.7134 6.42569 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 8.41842 5.73206 4.77227 9.45612 13.756 9.13872 numMergedOcc 0
2 mol 33 unq 2 iso 0 dist 8.41842 5.73206 4.77227 6.05212 11.5385 7.27307 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.71467 8.6338 7.92278 8.61908 12.6339 7.31677 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.21809 7.00234 6.99469 7.55848 5.69055 7.30652 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 5.69055 7.30652 6.99469 7.55848 7.21809 7.00234 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.25561 9.33989 6.6711 3.94577 8.97499 8.57953 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.97499 8.57953 6.6711 3.94577 7.25561 9.33989 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.67877 9.48694 8.10796 15.4322 14.1348 6.65267 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 5.01269 9.48694 5.55073 15.4322 12.1548 6.65267 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.3586 9.73865 12.4791 9.03348 16.8219 8.52591 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.65404 8.39087 4.49322 7.49794 13.4022 9.63473 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 8.49376 7.80506 10.0449 3.69868 6.9705 9.32606 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 6.9705 9.32606 10.0449 3.69868 8.49376 7.80506 numMergedOcc 0
14 mol 185 unq 0 iso 0 dist 8.2968 5.7065 7.94486 5.81461 10.2311 8.83768 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 9.5942 7.67573 9.6805 4.07375 11.34 5.71182 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 6.87565 8.39315 4.40152 9.80429 11.8021 9.72186 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 9.26313 6.94194 10.483 4.83206 12.002 6.74849 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 9.17911 5.9223 14.8337 8.6851 14.6254 8.53084 numMergedOcc 0
