0 mol 8 unq 0 iso 0 dist 7.46102 8.25051 8.96553 4.81384 8.33604 8.27181 9.91301 8.4069 9.62879 13.3876 8.16743 4.85329 10.2611 6.26865 12.9498 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 5.40367 6.35756 9.80755 8.89374 6.47744 9.01612 5.35073 6.86465 8.63333 15.5782 12.7331 12.4575 6.96494 10.6476 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 4.88613 5.40367 6.35756 9.80755 8.89374 6.47744 9.01612 5.35073 6.86465 8.63333 11.074 7.05413 9.58673 7.01363 5.92889 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 4.88613 5.40367 6.35756 9.80755 8.89374 6.47744 6.36193 4.81926 6.62496 11.5023 15.5782 12.7331 12.4575 6.96494 15.4158 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 4.88613 5.40367 6.35756 9.80755 8.89374 6.47744 6.36193 4.81926 6.62496 11.5023 11.074 7.05413 9.58673 7.01363 10.2241 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 10.4897 6.71911 5.33688 19.1673 12.5396 8.84665 12.8699 10.6421 5.3525 8.24062 6.5096 11.0387 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 6.65344 13.1729 7.71095 10.4897 6.71911 5.33688 14.3301 8.19458 8.25513 11.6249 10.6421 5.3525 8.24062 6.5096 9.15805 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 9.72689 13.7794 9.36773 7.10144 8.66514 8.4283 11.4004 5.57085 8.31336 10.6733 6.98838 5.90098 9.15979 7.71582 4.58465 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 9.72689 13.7794 9.36773 9.32959 9.25235 5.37521 11.4004 5.57085 8.31336 8.69012 6.98838 5.90098 9.15979 6.65776 4.58465 numMergedOcc 0
9 mol 88 unq 2 iso 0 dist 7.74197 4.0486 9.36773 10.0278 8.66514 8.4283 7.86537 5.57085 8.31336 10.6733 9.94935 5.90098 9.15979 7.71582 4.58465 numMergedOcc 0
10 mol 88 unq 3 iso 0 dist 7.74197 4.0486 9.36773 8.37153 9.25235 5.37521 7.86537 5.57085 8.31336 8.69012 9.94935 5.90098 9.15979 6.65776 4.58465 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.42513 8.60326 9.30299 10.2034 9.81878 4.77464 10.0998 7.30196 8.14887 11.7714 16.2351 14.085 8.59981 6.3244 14.9761 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 15.5083 11.965 6.29155 17.2931 10.7899 11.8989 19.3117 9.94276 23.8203 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 15.5083 11.965 6.29155 17.2931 11.5344 15.0734 20.5979 9.05357 26 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 15.5083 11.965 6.29155 17.2931 9.98051 9.58627 16.126 5.99299 20.0398 numMergedOcc 0
15 mol 133 unq 3 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 11.5178 7.79672 6.80239 15.1694 10.7899 11.8989 19.3117 9.94276 18.9016 numMergedOcc 0
16 mol 133 unq 4 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 11.5178 7.79672 6.80239 15.1694 11.5344 15.0734 20.5979 9.05357 22.3983 numMergedOcc 0
17 mol 133 unq 5 iso 0 dist 5.86531 9.73435 8.00618 5.80615 7.92688 12.2037 11.5178 7.79672 6.80239 15.1694 9.98051 9.58627 16.126 5.99299 17.3115 numMergedOcc 0
18 mol 155 unq 0 iso 0 dist 6.7973 5.01118 6.23493 5.10076 7.16254 6.3845 10.6879 5.71071 7.46303 9.14392 9.16944 4.9093 9.17284 6.51096 6.3437 numMergedOcc 0
19 mol 155 unq 1 iso 0 dist 6.7973 5.01118 6.23493 5.10076 7.16254 6.3845 10.6879 5.71071 7.46303 9.14392 13.3067 10.7896 13.2459 8.73171 9.99927 numMergedOcc 0
20 mol 155 unq 2 iso 0 dist 6.7973 5.01118 6.23493 9.64056 9.86313 5.86939 10.6879 5.71071 7.46303 7.51198 16.1194 13.5062 12.1081 7.37901 8.27726 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 8.39002 5.72088 6.57273 7.90095 6.87664 7.12232 8.46129 5.0744 6.60589 10.8259 14.5909 9.36098 10.0414 8.89778 12.5195 numMergedOcc 0
22 mol 224 unq 1 iso 0 dist 8.39002 5.72088 6.57273 7.90095 6.87664 7.12232 8.46129 5.0744 6.60589 10.8259 11.3096 5.29877 6.65984 9.47554 6.12232 numMergedOcc 0
23 mol 224 unq 2 iso 0 dist 8.39002 6.51315 5.78342 7.90095 6.87664 5.3621 8.46129 5.0744 9.16166 10.8259 14.5909 9.36098 12.7072 8.89778 12.5195 numMergedOcc 0
24 mol 224 unq 3 iso 0 dist 8.39002 6.51315 5.78342 7.90095 6.87664 5.3621 8.46129 5.0744 9.16166 10.8259 11.3096 5.29877 10.667 9.47554 6.12232 numMergedOcc 0
25 mol 224 unq 4 iso 0 dist 8.39002 6.51315 5.78342 7.90095 6.87664 5.3621 9.2053 5.60236 5.81334 10.2775 14.5909 9.36098 12.7072 8.89778 14.7761 numMergedOcc 0
26 mol 224 unq 5 iso 0 dist 8.39002 6.51315 5.78342 7.90095 6.87664 5.3621 9.2053 5.60236 5.81334 10.2775 11.3096 5.29877 10.667 9.47554 10.449 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 16.9465 9.5707 15.9563 12.3151 5.88703 6.56247 10.3388 10.0197 5.56749 15.004 8.49841 10.6156 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 7.86368 12.0816 9.45496 16.9465 9.5707 15.9563 12.3151 5.88703 6.56247 10.3388 16.337 12.1076 17.6567 9.6101 15.0456 numMergedOcc 0
29 mol 234 unq 2 iso 0 dist 7.86368 6.94762 6.7625 16.9465 9.5707 14.4106 12.3151 5.88703 9.36357 10.3388 10.0197 5.56749 10.8628 8.49841 10.6156 numMergedOcc 0
30 mol 234 unq 3 iso 0 dist 7.86368 6.94762 6.7625 16.9465 9.5707 14.4106 12.3151 5.88703 9.36357 10.3388 16.337 12.1076 12.6312 9.6101 15.0456 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 9.66555 12.2428 6.22714 8.92175 7.49471 5.17471 11.6545 5.34096 7.31233 7.19008 13.4351 12.1252 9.38422 6.17025 8.82861 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 8.67205 8.66185 6.22714 5.94371 7.49471 5.17471 11.1363 5.34096 7.31233 7.19008 11.5848 12.1252 9.38422 6.17025 8.82861 numMergedOcc 0
