0 mol 93 unq 0 iso 0 dist 8.6701 12.4843 7.13064 11.0239 5.64998 8.55758 numMergedOcc 0
1 mol 93 unq 1 iso 0 dist 8.6701 12.4843 7.13064 12.2046 4.76749 7.44027 numMergedOcc 0
2 mol 93 unq 2 iso 0 dist 6.85457 12.4843 7.8962 11.0239 4.34681 8.55758 numMergedOcc 0
3 mol 93 unq 3 iso 0 dist 6.85457 12.4843 7.8962 12.2046 5.73248 7.44027 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 7.64681 7.67811 9.46568 7.40983 7.86339 8.79886 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.27601 6.20949 4.86767 8.18356 3.67473 7.4113 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 6.50614 4.30031 5.12002 6.84006 4.26413 7.06763 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 9.2903 4.30031 8.46914 6.84006 3.64386 7.06763 numMergedOcc 0
8 mol 120 unq 2 iso 0 dist 9.97264 6.91192 5.12002 11.4085 4.26413 7.06763 numMergedOcc 0
9 mol 120 unq 3 iso 0 dist 9.29305 8.74749 5.12002 8.02114 4.26413 7.06763 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.96031 10.5408 9.2802 11.5717 3.74763 7.90621 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 8.96031 10.5408 9.2802 9.02402 4.4787 8.0943 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 5.64003 7.33309 7.37823 12.6566 11.5634 5.5223 numMergedOcc 0
13 mol 192 unq 1 iso 0 dist 5.64003 7.33309 7.37823 13.4136 12.3784 8.00501 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 7.27978 11.9253 5.4455 9.3032 3.7326 7.56217 numMergedOcc 0
15 mol 194 unq 1 iso 0 dist 7.27978 11.9253 5.4455 12.7181 7.29209 9.81055 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 9.86987 18.6263 8.86801 13.2701 6.85669 9.30035 numMergedOcc 0
17 mol 272 unq 1 iso 0 dist 9.86987 15.2564 7.15093 13.2701 6.85669 9.51185 numMergedOcc 0
18 mol 272 unq 2 iso 0 dist 9.88921 11.9608 8.86801 7.08918 6.85669 9.30035 numMergedOcc 0
19 mol 272 unq 3 iso 0 dist 9.88921 8.8375 7.15093 7.08918 6.85669 9.51185 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 9.44925 9.0925 9.38952 10.3884 8.71368 7.00616 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 9.95662 10.1082 4.87349 5.06373 9.94624 8.2236 numMergedOcc 0
