0 mol 0 unq 0 iso 0 dist 9.42137 7.65884 9.23213 12.7756 8.81979 9.14029 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 9.42137 12.7756 8.81979 7.65884 9.23213 9.14029 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.58841 10.5948 8.97793 13.8628 8.19682 5.67347 numMergedOcc 0
3 mol 76 unq 0 iso 1 dist 8.58841 13.8628 8.19682 10.5948 8.97793 5.67347 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.72689 7.10144 8.66514 9.32959 9.25235 4.61166 numMergedOcc 0
5 mol 88 unq 0 iso 1 dist 9.72689 9.32959 9.25235 7.10144 8.66514 4.61166 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 7.74197 10.0278 8.66514 8.37153 9.25235 4.61166 numMergedOcc 0
7 mol 88 unq 1 iso 1 dist 7.74197 8.37153 9.25235 10.0278 8.66514 4.61166 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 4.98864 5.46352 6.99777 10.1017 9.14376 11.889 numMergedOcc 0
9 mol 115 unq 0 iso 1 dist 4.98864 10.1017 9.14376 5.46352 6.99777 11.889 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 7.95871 10.3995 6.99777 9.81323 9.14376 11.889 numMergedOcc 0
11 mol 115 unq 1 iso 1 dist 7.95871 9.81323 9.14376 10.3995 6.99777 11.889 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 5.49877 6.53156 6.89257 4.72188 8.74308 6.09983 numMergedOcc 0
13 mol 130 unq 0 iso 1 dist 5.49877 4.72188 8.74308 6.53156 6.89257 6.09983 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 7.81337 6.25099 6.91348 14.8295 9.51418 10.2027 numMergedOcc 0
15 mol 131 unq 0 iso 1 dist 7.81337 14.8295 9.51418 6.25099 6.91348 10.2027 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 6.7973 5.10076 7.16254 9.64056 9.86313 7.63368 numMergedOcc 0
17 mol 155 unq 0 iso 1 dist 6.7973 9.64056 9.86313 5.10076 7.16254 7.63368 numMergedOcc 0
18 mol 155 unq 1 iso 0 dist 4.44292 4.40049 7.39644 6.61119 7.70572 9.42764 numMergedOcc 0
19 mol 155 unq 1 iso 1 dist 4.44292 6.61119 7.70572 4.40049 7.39644 9.42764 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.84952 11.14 7.98142 10.9006 7.37327 6.46849 numMergedOcc 0
21 mol 181 unq 0 iso 1 dist 9.84952 10.9006 7.37327 11.14 7.98142 6.46849 numMergedOcc 0
22 mol 213 unq 0 iso 0 dist 7.88794 4.23514 6.68292 6.58235 4.26212 4.8814 numMergedOcc 0
23 mol 213 unq 0 iso 1 dist 7.88794 6.58235 4.26212 4.23514 6.68292 4.8814 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.51764 6.09245 6.97182 10.8345 6.1175 5.93129 numMergedOcc 0
25 mol 214 unq 0 iso 1 dist 9.51764 10.8345 6.1175 6.09245 6.97182 5.93129 numMergedOcc 0
26 mol 214 unq 1 iso 0 dist 5.36829 8.69149 6.97182 6.00706 6.1175 5.93129 numMergedOcc 0
27 mol 214 unq 1 iso 1 dist 5.36829 6.00706 6.1175 8.69149 6.97182 5.93129 numMergedOcc 0
28 mol 218 unq 0 iso 0 dist 8.5119 9.20149 7.18041 11.711 7.17547 9.17818 numMergedOcc 0
29 mol 218 unq 0 iso 1 dist 8.5119 11.711 7.17547 9.20149 7.18041 9.17818 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 7.86368 16.9465 9.5707 15.442 7.85175 5.32617 numMergedOcc 0
31 mol 234 unq 0 iso 1 dist 7.86368 15.442 7.85175 16.9465 9.5707 5.32617 numMergedOcc 0
32 mol 236 unq 0 iso 0 dist 8.90987 14.3961 7.17676 12.7435 6.68463 7.88539 numMergedOcc 0
33 mol 236 unq 0 iso 1 dist 8.90987 12.7435 6.68463 14.3961 7.17676 7.88539 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 6.42725 7.53102 6.77938 6.58569 7.76676 6.1415 numMergedOcc 0
35 mol 259 unq 0 iso 1 dist 6.42725 6.58569 7.76676 7.53102 6.77938 6.1415 numMergedOcc 0
36 mol 264 unq 0 iso 0 dist 8.43858 12.5468 9.0012 15.8008 9.5784 6.20393 numMergedOcc 0
37 mol 264 unq 0 iso 1 dist 8.43858 15.8008 9.5784 12.5468 9.0012 6.20393 numMergedOcc 0
38 mol 293 unq 0 iso 0 dist 9.55282 4.37303 9.47908 11.0749 9.97212 7.08365 numMergedOcc 0
39 mol 293 unq 0 iso 1 dist 9.55282 11.0749 9.97212 4.37303 9.47908 7.08365 numMergedOcc 0
