0 mol 4 unq 0 iso 0 dist 5.39008 12.7044 9.12428 9.39293 7.29079 11.2087 6.10734 5.12621 8.24634 11.2242 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 5.39008 12.7044 9.12428 9.39293 7.29079 11.2087 15.6929 14.8379 9.16617 18.2606 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 5.39008 12.7044 9.12428 9.39293 7.29079 11.2087 17.7704 15.2242 8.87255 19.6106 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.7939 10.3774 7.23812 8.50831 7.9575 15.0358 14.1293 14.7042 9.24757 20.9505 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.44695 12.6626 7.23812 11.1595 7.9575 15.0358 21.4221 14.7042 9.24757 20.9505 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 5.68894 9.64124 7.23812 10.3098 7.9575 15.0358 17.6925 14.7042 9.24757 20.9505 numMergedOcc 0
6 mol 204 unq 0 iso 0 dist 9.23669 15.0515 9.44947 5.41527 8.98633 12.2033 13.4344 4.29037 9.68728 13.0868 numMergedOcc 0
7 mol 226 unq 0 iso 0 dist 8.24741 12.6212 9.30975 10.4 9.84378 15.6259 6.82883 4.66376 8.80683 13.0915 numMergedOcc 0
8 mol 226 unq 1 iso 0 dist 8.24741 10.78 9.14028 10.4 9.84378 17.0074 6.82883 4.66376 6.11704 13.0915 numMergedOcc 0
9 mol 226 unq 2 iso 0 dist 5.07958 9.83787 9.30975 5.92594 9.84378 15.6259 8.22518 4.66376 8.80683 13.0915 numMergedOcc 0
10 mol 226 unq 3 iso 0 dist 5.07958 11.3247 9.14028 5.92594 9.84378 17.0074 8.22518 4.66376 6.11704 13.0915 numMergedOcc 0
11 mol 226 unq 4 iso 0 dist 6.19519 6.6871 9.30975 15.5677 9.84378 15.6259 6.02803 4.66376 8.80683 13.0915 numMergedOcc 0
12 mol 226 unq 5 iso 0 dist 6.19519 6.19485 9.14028 15.5677 9.84378 17.0074 6.02803 4.66376 6.11704 13.0915 numMergedOcc 0
13 mol 244 unq 0 iso 0 dist 6.2667 8.82711 9.21656 7.17774 9.45199 8.49798 5.60146 4.89551 5.50492 9.30179 numMergedOcc 0
14 mol 244 unq 1 iso 0 dist 6.2667 8.82711 9.21656 5.2958 9.07512 9.54706 5.60146 4.89551 5.50492 6.10489 numMergedOcc 0
15 mol 248 unq 0 iso 0 dist 7.51278 5.68749 8.98788 10.0975 9.99025 13.5822 10.1331 6.71088 7.16525 14.088 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 5.76281 5.31774 9.42899 6.06968 9.97897 10.1601 11.8112 11.0964 9.70714 17.8218 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 8.76302 6.00593 8.41236 7.97612 8.82003 7.88913 13.1145 11.7852 7.46394 10.3734 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 9.11322 12.4287 8.41236 5.60035 8.82003 7.88913 13.7102 11.7852 7.46394 10.3734 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.326 5.55176 3.65199 10.0458 9.62532 9.65934 9.25759 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.326 5.55176 3.65199 10.0458 9.62532 9.65934 9.25759 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 9.24592 8.598 7.7743 10.326 5.55176 3.65199 10.0458 9.62532 9.65934 9.25759 numMergedOcc 0
