0 mol 10 unq 0 iso 0 dist 9.31452 6.23648 6.47443 8.95503 6.17554 6.02154 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.60039 12.5088 9.22796 14.5111 9.03714 5.9809 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 9.47447 6.53202 7.49245 14.5144 9.57455 9.76686 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 9.28645 3.78964 7.77418 9.45003 10.9659 6.12922 numMergedOcc 0
4 mol 155 unq 0 iso 0 dist 6.80942 5.68679 8.14405 7.50392 7.441 7.29911 numMergedOcc 0
5 mol 155 unq 1 iso 0 dist 6.80942 5.68679 8.14405 8.77391 6.79302 5.36254 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 9.32658 3.72135 8.0852 7.65559 4.55959 6.65272 numMergedOcc 0
7 mol 162 unq 1 iso 0 dist 9.32658 7.66483 8.83222 7.65559 4.55959 9.66989 numMergedOcc 0
8 mol 194 unq 0 iso 0 dist 9.08655 3.86206 9.26885 6.289 9.24953 6.11135 numMergedOcc 0
9 mol 194 unq 1 iso 0 dist 9.08655 3.86206 9.26885 9.99555 11.5934 6.54481 numMergedOcc 0
10 mol 194 unq 2 iso 0 dist 9.08655 3.86206 9.26885 10.6164 8.10542 8.03403 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 6.9612 7.95009 5.66071 17.4116 12.2974 9.74988 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 4.86882 6.61517 5.66071 14.9263 12.2974 9.74988 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 7.71569 5.47184 6.91906 10.5513 5.24956 8.70987 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.64341 7.79226 9.94612 12.2614 13.0669 8.31974 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 7.31315 11.122 9.94612 15.8262 13.0669 8.31974 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 5.83646 3.72761 5.41453 10.4661 11.6924 7.39547 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 5.83646 3.72761 5.41453 9.57914 5.61491 7.24334 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 7.85081 7.1875 5.52484 14.3035 7.35295 8.53041 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.80725 9.92544 9.2885 9.53092 5.4536 8.84648 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 9.69083 12.9436 8.39635 18.4403 11.0363 9.60574 numMergedOcc 0
21 mol 283 unq 1 iso 0 dist 5.96202 3.77125 8.39635 11.5064 11.0363 9.60574 numMergedOcc 0
22 mol 283 unq 2 iso 0 dist 9.55068 11.2772 8.39635 18.8102 11.0363 9.60574 numMergedOcc 0
