0 mol 16 unq 0 iso 0 dist 9.76968 8.55371 5.47769 13.862 5.32694 6.58035 18.4854 13.0191 10.9633 8.41862 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 9.80755 8.89374 10.3132 8.62958 6.46761 15.3772 14.3086 6.44201 7.58407 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 4.88613 9.80755 8.89374 16.5848 14.176 9.73139 15.3772 14.3086 6.44201 6.31428 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.99491 6.84612 8.68586 13.8335 10.6748 9.54144 12.954 13.3487 6.23335 9.80142 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 5.02717 9.81097 8.66155 12.5189 7.69052 9.66954 16.0109 12.2309 12.0796 7.64585 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.91337 6.02826 7.39889 13.3911 11.3169 7.44174 15.8306 17.0377 11.6138 9.38288 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 7.91337 6.02826 7.39889 13.3911 11.3169 7.44174 13.8574 15.1819 8.58342 6.19042 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 5.49877 6.53156 6.89257 9.72083 7.50049 7.66168 4.72188 8.74308 6.09983 9.12581 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 5.49877 4.72188 8.74308 9.72083 7.50049 9.12581 6.53156 6.89257 6.09983 7.66168 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 6.7973 5.10076 7.16254 10.6879 5.71071 9.14392 9.64056 9.86313 7.63368 7.51198 numMergedOcc 0
10 mol 155 unq 1 iso 0 dist 6.7973 9.64056 9.86313 10.6879 5.71071 7.51198 5.10076 7.16254 7.63368 9.14392 numMergedOcc 0
11 mol 155 unq 2 iso 0 dist 4.44292 4.40049 7.39644 10.6076 10.7616 7.36102 8.63858 11.5473 5.68272 9.38946 numMergedOcc 0
12 mol 155 unq 3 iso 0 dist 4.44292 6.61119 7.70572 10.449 7.01918 8.65888 12.8149 12.0728 10.1369 9.87281 numMergedOcc 0
13 mol 155 unq 4 iso 0 dist 4.44292 6.61119 7.70572 10.449 7.01918 8.65888 10.813 10.6403 5.44147 8.27111 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 8.5119 11.711 7.17547 13.3259 7.83217 7.13323 9.87203 9.29802 4.63933 9.50586 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 9.13537 6.16476 5.38637 9.01016 5.42006 6.55759 5.72503 9.98024 6.44245 7.02475 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 9.13537 6.16476 5.38637 9.01016 5.42006 6.55759 8.59287 12.0632 10.677 7.67322 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 9.13537 6.16476 5.38637 9.01016 5.42006 6.55759 14.7379 12.0365 12.1411 7.19008 numMergedOcc 0
18 mol 238 unq 3 iso 0 dist 9.32451 4.81145 6.05141 11.5933 5.6348 8.09066 15.5522 10.6978 10.9258 8.14172 numMergedOcc 0
19 mol 238 unq 4 iso 0 dist 9.32451 4.81145 6.05141 10.7555 8.87326 7.2766 15.5522 10.6978 10.9258 6.77463 numMergedOcc 0
20 mol 238 unq 5 iso 0 dist 9.66555 8.92175 7.49471 11.6545 5.34096 7.19008 18.1876 10.5202 12.1411 6.55759 numMergedOcc 0
21 mol 238 unq 6 iso 0 dist 9.66555 8.92175 7.49471 11.6545 5.34096 7.19008 16.4667 12.1784 10.1756 7.02475 numMergedOcc 0
22 mol 238 unq 7 iso 0 dist 9.66555 8.92175 7.49471 11.6545 5.34096 7.19008 13.1765 12.1937 9.50847 7.67322 numMergedOcc 0
23 mol 238 unq 8 iso 0 dist 8.67205 5.94371 7.49471 11.1363 5.34096 7.19008 17.0559 10.5202 12.1411 6.55759 numMergedOcc 0
24 mol 238 unq 9 iso 0 dist 8.67205 5.94371 7.49471 11.1363 5.34096 7.19008 15.6785 12.1784 10.1756 7.02475 numMergedOcc 0
25 mol 238 unq 10 iso 0 dist 8.67205 5.94371 7.49471 11.1363 5.34096 7.19008 13.7646 12.1937 9.50847 7.67322 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 9.96394 5.98845 6.73206 13.3211 5.40809 9.09992 14.0341 10.1966 9.75529 6.16449 numMergedOcc 0
27 mol 293 unq 0 iso 0 dist 6.27435 4.37303 8.56847 9.55282 10.9721 9.47908 11.0749 14.1253 7.08365 9.97212 numMergedOcc 0
