0 mol 5 unq 0 iso 0 dist 8.34146 8.72524 6.38154 4.47188 7.44029 4.98321 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.88556 9.06787 7.7687 9.58409 9.5194 5.40489 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.18358 7.56 3.80156 6.06978 7.58743 8.51259 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 6.34149 8.25027 13.8717 5.815 11.87 7.48208 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.63279 8.25027 15.2333 5.815 14.1358 7.48208 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 6.29701 8.55869 5.56349 12.5648 12.961 9.79585 numMergedOcc 0
6 mol 168 unq 0 iso 0 dist 8.80094 5.69346 13.358 5.5458 12.4546 8.32353 numMergedOcc 0
7 mol 168 unq 1 iso 0 dist 9.03681 5.69346 4.92763 5.5458 8.53936 8.32353 numMergedOcc 0
8 mol 168 unq 2 iso 0 dist 8.07126 8.55388 13.358 4.858 12.4546 8.32353 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.39622 5.09756 3.6848 5.565 6.26168 8.5672 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 5.39622 7.44523 5.33968 8.84505 9.18289 5.67168 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.05227 5.65314 10.9673 4.26432 6.0033 6.69042 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 9.60654 9.48525 16.0311 12.5148 21.5028 9.3502 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 9.60654 9.48525 16.0311 8.62768 13.3046 9.34821 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 9.60654 9.48525 16.0311 4.57447 13.7049 6.46405 numMergedOcc 0
15 mol 225 unq 3 iso 0 dist 7.11262 9.48525 6.04066 12.5148 14.0586 9.3502 numMergedOcc 0
16 mol 225 unq 4 iso 0 dist 7.11262 9.48525 6.04066 8.62768 9.27308 9.34821 numMergedOcc 0
17 mol 225 unq 5 iso 0 dist 7.11262 9.48525 6.04066 4.57447 7.25438 6.46405 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 7.09902 7.79426 3.98113 4.12865 8.7831 9.01338 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 9.6748 7.42359 6.76489 5.69077 10.4087 8.30024 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 9.6748 7.42359 6.76489 9.70906 13.0938 8.20943 numMergedOcc 0
21 mol 243 unq 2 iso 0 dist 8.71177 7.42359 3.72181 5.69077 11.2498 8.30024 numMergedOcc 0
22 mol 243 unq 3 iso 0 dist 8.71177 7.42359 3.72181 9.70906 10.7708 8.20943 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 6.84909 8.51266 11.4255 6.03672 10.2238 7.89938 numMergedOcc 0
