0 mol 0 unq 0 iso 0 dist 7.20999 5.56011 7.65806 4.21143 9.67081 8.29174 11.0785 6.0225 9.72725 14.6538 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.23095 11.5983 6.03987 5.24477 7.03372 9.92243 9.39274 4.77954 7.99919 11.6392 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 6.68311 15.0607 9.96708 4.61081 4.86198 10.7434 12.0518 5.69391 9.55118 9.92478 numMergedOcc 0
3 mol 72 unq 1 iso 0 dist 6.68311 15.0607 9.96708 4.61081 4.86198 10.7434 19.2494 13.4212 9.10345 15.6544 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.05602 12.0507 5.08437 12.6133 7.92856 8.29813 9.55337 3.9764 5.10496 11.36 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.05602 4.72129 6.48948 12.6133 7.92856 13.2057 9.55337 3.9764 5.92242 11.36 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 8.05602 4.72129 6.48948 12.6133 7.92856 13.2057 4.79891 7.03983 7.02507 8.7081 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 8.05602 12.0339 6.10456 12.6133 7.92856 12.7473 15.2414 10.4782 7.54889 17.395 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 8.05602 12.0339 6.10456 12.6133 7.92856 12.7473 9.55337 3.9764 5.2571 11.36 numMergedOcc 0
9 mol 142 unq 0 iso 0 dist 7.15087 8.68855 9.2313 5.19808 8.04118 4.05822 5.90339 4.67662 7.81207 5.42679 numMergedOcc 0
10 mol 142 unq 1 iso 0 dist 7.15087 8.68855 9.2313 5.19808 8.04118 4.05822 15.501 13.5913 7.18002 11.1832 numMergedOcc 0
11 mol 142 unq 2 iso 0 dist 7.15087 5.50176 5.31024 5.19808 8.04118 4.7832 5.90339 4.67662 6.14151 5.42679 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 8.62303 7.13783 13.3822 16.3573 13.514 6.52816 19.8921 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 5.47561 5.60111 7.21333 9.2281 5.1609 8.89157 8.51427 6.84862 5.56538 8.88902 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 5.47561 5.60111 7.21333 9.2281 5.1609 8.89157 11.6182 9.53117 7.48954 9.83916 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.61729 7.02319 6.16342 8.18179 4.43499 4.32238 11.7534 10.6736 6.73665 10.5638 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.57619 5.43184 5.30224 7.70492 9.18798 5.96249 9.2885 4.04513 8.03219 12.3781 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.57619 5.43184 5.30224 7.70492 9.18798 5.96249 10.5384 7.09907 6.9899 12.745 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 8.57619 5.43184 5.30224 10.388 8.25897 5.97386 9.2885 4.04513 8.03219 12.1864 numMergedOcc 0
19 mol 259 unq 3 iso 0 dist 8.57619 5.43184 5.30224 10.388 8.25897 5.97386 10.5384 7.09907 6.9899 10.838 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 8.80588 8.30978 6.53701 9.17893 6.01897 6.87492 6.16546 4.90315 6.02353 8.96231 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 8.80588 5.80223 6.0664 9.17893 6.01897 3.51781 6.16546 4.90315 6.86234 8.96231 numMergedOcc 0
