0 mol 1 unq 0 iso 0 dist 7.81034 6.4181 4.58277 5.06184 10.3005 6.86701 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19497 6.4181 9.98089 5.06184 13.546 6.86701 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 5.38703 9.91301 10.1093 13.8883 16.8517 9.01112 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 9.82294 8.99491 5.9853 9.07673 10.6898 9.86334 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 8.39857 9.46247 8.06806 3.77705 10.3748 8.3733 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 7.30652 5.47319 7.0643 4.69809 10.5659 5.99857 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 7.30652 9.8809 15.5982 4.69809 10.5659 6.9362 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 9.33989 9.71952 8.73236 6.69911 6.55112 8.13108 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 8.57953 7.28257 8.73236 3.94216 6.55112 8.13108 numMergedOcc 0
9 mol 76 unq 2 iso 0 dist 8.92491 7.47794 7.84269 12.1618 14.609 9.13322 numMergedOcc 0
10 mol 76 unq 3 iso 0 dist 7.41861 6.4551 10.6009 5.79134 12.9253 9.6952 numMergedOcc 0
11 mol 88 unq 0 iso 0 dist 8.87089 7.74197 14.8536 11.151 14.8596 7.80898 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.29249 7.5819 9.40813 5.23795 14.0822 9.33861 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 5.81553 5.17585 4.87668 3.82552 6.6536 4.22363 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 5.73946 5.02717 4.75197 5.33827 7.84768 7.69765 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 5.73946 5.02717 4.75197 12.6105 12.5457 9.42082 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.73038 5.82404 9.67676 11.5628 10.3522 8.77023 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.13534 7.41378 4.62576 4.76079 5.97971 5.05973 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 5.47586 8.10287 7.78052 3.50446 7.53734 8.4844 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 6.60429 8.10287 13.0749 3.50446 9.79826 8.4844 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 4.87053 7.85877 9.84386 4.91709 7.99441 5.56538 numMergedOcc 0
21 mol 222 unq 1 iso 0 dist 4.87053 7.85877 9.84386 5.96186 6.71817 7.48954 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 8.93518 6.42725 9.50515 11.761 15.2734 8.03219 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 8.93518 6.42725 9.50515 6.09466 9.51375 6.9899 numMergedOcc 0
