0 mol 58 unq 0 iso 0 dist 6.36193 5.84625 9.95364 4.99692 9.22598 9.01564 4.88613 4.81926 5.49591 8.96727 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 4.88613 5.84625 5.49591 4.99692 8.96727 9.01564 6.36193 4.81926 9.95364 9.22598 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.1599 8.67162 10.0059 5.46563 6.9103 12.5091 14.3699 8.62608 18.0795 9.69044 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.1599 8.79114 10.4611 5.46563 6.9103 13.1416 14.3699 8.62608 19.0345 9.69044 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 5.47319 8.91502 5.83934 4.69809 5.99857 11.4374 9.8809 8.99811 14.3583 6.9362 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 9.8809 8.91502 14.3583 4.69809 6.9362 11.4374 5.47319 8.99811 5.83934 5.99857 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.58841 7.75211 4.3931 16.3337 9.85905 13.8179 17.86 10.2879 12.7241 6.72869 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 5.17585 8.23777 5.76098 3.82552 4.22363 5.36587 10.5503 6.34999 7.64054 7.7988 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 5.17585 8.23777 5.76098 3.82552 4.22363 5.36587 10.5069 6.72751 10.9474 9.40824 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.18763 9.34823 5.13589 5.92411 8.95212 8.67537 8.44385 10.9871 10.8661 6.99446 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.18763 9.34823 5.13589 5.92411 8.95212 8.67537 5.63005 9.93257 12.0175 7.64052 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 8.44385 9.34823 10.8661 5.92411 6.99446 8.67537 6.18763 10.9871 5.13589 8.95212 numMergedOcc 0
12 mol 119 unq 3 iso 0 dist 8.44385 9.34823 10.8661 5.92411 6.99446 8.67537 5.63005 4.85907 12.0175 7.64052 numMergedOcc 0
13 mol 119 unq 4 iso 0 dist 5.63005 9.34823 12.0175 5.92411 7.64052 8.67537 6.18763 9.93257 5.13589 8.95212 numMergedOcc 0
14 mol 119 unq 5 iso 0 dist 5.63005 9.34823 12.0175 5.92411 7.64052 8.67537 8.44385 4.85907 10.8661 6.99446 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.58911 5.66363 11.85 17.3349 8.59874 17.8171 9.86845 6.01247 8.91338 9.76212 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 8.10287 8.86587 14.0496 3.50446 8.4844 11.992 8.84602 10.817 13.8461 7.21137 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 9.83721 8.4302 5.754 14.007 7.81897 13.2103 15.3011 5.74182 10.8766 6.34915 numMergedOcc 0
18 mol 267 unq 0 iso 0 dist 9.62043 9.80577 8.37094 8.3484 7.34981 6.27154 14.5482 5.91646 9.14203 8.8293 numMergedOcc 0
